SCHEMBL6987829

SCHEMBL6987829

O=C(Cl)c1cnc(Cl)nc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAPRT Q6XQN6 1/20 0.46
JUN P05412 1/20 0.41
NFKB1 P19838 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
KCNQ3 O43525 7/20 0.38
KCNQ2 O43526 7/20 0.38
KCNQ5 Q9NR82 6/20 0.38
KCNE1 P15382 5/20 0.38
KCNQ1 P51787 5/20 0.38
SIRT6 Q8N6T7 1/20 0.37
DGAT1 O75907 1/20 0.35
P4HA1 P13674 2/20 0.34
P4HTM Q9NXG6 2/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
MIF P14174 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
MDM4 O15151 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL14782157 0.79 NAPRT (0.41) NAPRTSIRT6DGAT1P4HA1P4HTM
SCHEMBL63857 0.79 NAPRT (0.58) NAPRTJUNNFKB1NFKB2RELA
SCHEMBL31497513 0.77 HDAC1 (0.56) NAPRTSIRT6P4HA1P4HTMSMN1; SMN2
SCHEMBL1968189 0.77 NNMT (0.50) NAPRTJUNNFKB1NFKB2RELA
SCHEMBL20396058 0.77 NAPRT (0.40) NAPRTSIRT6DGAT1P4HA1P4HTM
SCHEMBL600134 0.77 NAPRT (0.40) NAPRTJUNNFKB1NFKB2RELA
SCHEMBL4123825 0.77 NAPRT (0.40) NAPRTDGAT1P4HA1P4HTMRAB9A
SCHEMBL17801 0.75 NAPRT (0.72) NAPRTKCNQ3KCNQ2KCNE1KCNQ1
Hydrochloric Acid SCHEMBL4040974 0.75 HDAC1 (0.54) NAPRTSIRT6P4HA1P4HTMSMN1; SMN2
SCHEMBL29760376 0.75 NAPRT (0.72) NAPRTKCNQ3KCNQ2KCNE1KCNQ1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 59 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025122865-A1 BIFUNCTIONAL ABL1-BINDING COMPOUNDS AND USES THEREOF PHOTYS THERAPEUTICS, INC. (US) 2025-06-12 WO disclosed
US-20250136611-A1 HETEROBIFUNCTIONAL COMPOUNDS AND METHODS OF TREATING DISEASE HALDA THERAPEUTICS OPCO, INC. 2025-05-01 US disclosed
WO-2025085738-A1 HETEROBIFUNCTIONAL COMPOUNDS AND METHODS OF TREATING DISEASE HALDA THERAPEUTICS OPCO, INC. (US) 2025-04-24 WO disclosed
US-20250129070-A1 BIFUNCTIONAL ANDROGEN RECEPTOR COMPOUNDS KOLM THERAPEUTICS INC. 2025-04-24 US disclosed
WO-2025081082-A1 BIFUNCTIONAL ANDROGEN RECEPTOR COMPOUNDS KOLM THERAPEUTICS INC. (US) 2025-04-17 WO disclosed
CN-119684814-A Yellow dichromatic dye and application thereof 烟台海森大数据有限公司 2025-03-25 CN disclosed
US-12145929-B2 Piperidine derivative and pharmaceutical composition for inhibiting autotaxin comprising same NEXTGEN BIOSCIENCE CO., LTD. (KR) 2024-11-19 US disclosed
US-20240279216-A1 NOVEL PIPERIDINE DERIVATIVE AND PHARMACEUTICAL COMPOSITION FOR INHIBITING AUTOTAXIN COMPRISING SAME NEXTGEN BIOSCIENCE CO., LTD. (KR) 2024-08-22 US disclosed
EP-4353720-A1 NOVEL PIPERIDINE DERIVATIVE AND PHARMACEUTICAL COMPOSITION FOR INHIBITING AUTOTAXIN COMPRISING SAME Nextgen Bioscience Co., Ltd. (KR) 2024-04-17 EP disclosed
CN-117396471-A Novel piperidine derivatives and pharmaceutical compositions for inhibiting autotaxin comprising the same 株式会社次代生物科学 2024-01-12 CN disclosed
CN-1196685-C Pyrimidine derivatives ASTRAZENCA AB (SE) 2005-04-13 CN disclosed
CN-1541208-A 2-phenylamino-pyrimidine derivatives as cyclin dependent kinase inhibitors 2004-10-27 CN disclosed
EP-1361879-A1 2,4-DISUBSTITUTED PYRIMIDINE-5-CARBOXAMIDE DERIVATIVES AS KCNQ POTASSIUM CHANNEL MODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2003-11-19 EP disclosed
CN-1454210-A Pyrimidine derivatives ASTRAZENCA AB (SE) 2003-11-05 CN disclosed
US-20020183335-A1 Administering disubstituted pyrimidine-5-carboxamide derivatives for therapy of disorders responsive to the modulation of the potassium channels BRISTOL-MYERS SQUIBB COMPANY 2002-12-05 US disclosed
WO-2002066036-A1 2,4-DISUBSTITUTED PYRIMIDINE-5-CARBOXAMIDE DERIVATIVES AS KCNQ POTASSIUM CHANNEL MODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2002-08-29 WO disclosed
US-5935966-A COMPOUNDS THAT BLOCK THE ACTIVATION OF TRANSCRIPTION FACTORS THROUGH INHIBITION OF A FAMILY OF SPECIFIC KINASES, DECREASING PROINFLAMMATORY PROTEINS TO TREAT AUTOIMMUNE DISEASES AND AS GENERAL ANTIINFLAMMATORY AGENTS SIGNAL PHARMACEUTICALS, INC. (US) 1999-08-10 US disclosed
US-5852028-A Pyrimidine carboxylates and related compounds and methods for treating inflammatory conditions SIGNAL PHARMACEUTICALS, INC. (US) 1998-12-22 US disclosed
WO-1998038171-A1 PYRIMIDINE CARBOXYLATES AND RELATED COMPOUNDS AND METHODS FOR TREATING INFLAMMATORY CONDITIONS SIGNAL PHARMACEUTICALS, INC. (US) 1998-09-03 WO disclosed
WO-1997009325-A1 PYRIMIDINE CARBOXYLATES AND RELATED COMPOUNDS AND METHODS FOR TREATING INFLAMMATORY CONDITIONS SIGNAL PHARMACEUTICALS, INC. (US) 1997-03-13 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240279216-A1 NOVEL PIPERIDINE DERIVATIVE AND PHARMACEUTICAL COMPOSITION FOR INHIBITING AUTOTAXIN COMPRISING SAME ENPP2, UACA, ITCH NAPRT 955/4885JUN 3937/4885NFKB1 797/4885
US-20250136611-A1 HETEROBIFUNCTIONAL COMPOUNDS AND METHODS OF TREATING DISEASE VHL, BRCA1, TP53 NAPRT 2760/4885JUN 2441/4885NFKB1 1418/4885
US-20020183335-A1 Administering disubstituted pyrimidine-5-carboxamide derivatives for therapy of disorders responsive to the modulation of the potassium channels KCNQ5, KCNQ1, KCNQ2 NAPRT 1457/4885JUN 3580/4885NFKB1 1080/4885
US-12145929-B2 Piperidine derivative and pharmaceutical composition for inhibiting autotaxin comprising same ENPP2, UACA, ACAT2 NAPRT 988/4885JUN 3843/4885NFKB1 963/4885
US-20250129070-A1 BIFUNCTIONAL ANDROGEN RECEPTOR COMPOUNDS AR, SHBG, FSHR NAPRT 3830/4885JUN 4270/4885NFKB1 1571/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.