SCHEMBL8055545

SCHEMBL8055545

CCc1nc(Br)cnc1N

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR4 P51679 1/20 0.38
KMT2A Q03164 2/20 0.35
HTT P42858 1/20 0.35
MAPKAPK2 P49137 2/20 0.35
EDNRA P25101 1/20 0.35
HEXA P06865 5/20 0.34
HEXB P07686 5/20 0.34
DHFR P00374 4/20 0.34
ATR Q13535 1/20 0.33
ADORA3 P0DMS8 1/20 0.33
ADORA2A P29274 1/20 0.33
ADORA2B P29275 1/20 0.33
ADORA1 P30542 1/20 0.33
MEN1 O00255 1/20 0.33
SLC22A1 O15245 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 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
SCHEMBL30427027 1.00 CCR4 (0.38) CCR4KMT2AHTTMAPKAPK2EDNRA
SCHEMBL11229329 0.80 CCR4 (0.39) CCR4EDNRA
SCHEMBL14703937 0.80 HTT (0.37) KMT2AHTTMAPKAPK2ATR
SCHEMBL7418341 0.80 HTT (0.37) KMT2AHTTMAPKAPK2ATR
SCHEMBL10399429 0.80 GABRP (0.40) KMT2AMAPKAPK2HEXAHEXBDHFR
SCHEMBL28196797 0.78 MAPKAPK2 (0.49) KMT2AMAPKAPK2HEXAHEXBDHFR
SCHEMBL10394906 0.78 MAPKAPK2 (0.44) MAPKAPK2HEXAHEXBDHFR
SCHEMBL1585295 0.78 ATR (0.37) KMT2AHTTMAPKAPK2ATRADORA2A
SCHEMBL1585158 0.78 ACVR1 (0.33) KMT2AHTTEDNRAATR
SCHEMBL11223672 0.77 CCR4 (0.38) CCR4EDNRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4262788-B1 UREA OREXIN RECEPTOR AGONISTS MERCK SHARP & DOHME LLC (US) 2026-01-21 EP disclosed
US-12448368-B2 Indole compounds as androgen receptor modulators NIDO BIOSCIENCES, INC. (US) 2025-10-21 US disclosed
US-20250122192-A1 5-PYRIMIDINECARBOXAMIDE DERIVATIVES AND METHODS OF USING THE SAME RGENTA THERAPEUTICS, INC. 2025-04-17 US disclosed
US-20250122176-A1 INDOLE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS NIDO BIOSCIENCES INC (US) 2025-04-17 US disclosed
US-20250092021-A9 INDOLE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS NIDO BIOSCIENCES, INC. 2025-03-20 US disclosed
US-20250066389-A1 HETEROCYCLIC AMIDES AND METHODS OF USING THE SAME RGENTA THERAPEUTICS, INC. 2025-02-27 US disclosed
CN-118786117-A Heterocyclic amides and methods of use thereof 亚根达医疗公司 2024-10-15 CN disclosed
EP-4441042-A1 5-PYRIMIDINECARBOXAMIDE DERIVATIVES AND METHODS OF USING THE SAME Rgenta Therapeutics, Inc. (US) 2024-10-09 EP disclosed
CN-118748995-A 5-Pyrimidine carboxamide derivatives and methods of use thereof 亚根达医疗公司 2024-10-08 CN disclosed
EP-4433457-A1 HETEROCYCLIC AMIDES AND METHODS OF USING THE SAME Rgenta Therapeutics, Inc. (US) 2024-09-25 EP disclosed
US-20170197969-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY HOFFMANN-LA ROCHE INC. (US) 2017-07-13 US disclosed
EP-3160967-A1 IMIDAZO[1,2-A]PYRAZIN-1YL-BENZAMIDE COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY F. Hoffmann-La Roche AG (CH) 2017-05-03 EP disclosed
CN-106459067-A Imidazo[1,2-A]pyrazin-1yl-benzamide compounds for treating spinal muscular atrophy 豪夫迈·罗氏有限公司 2017-02-22 CN disclosed
US-20160331756-A1 HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS OXFORD FINANCE LLC, AS COLLATERAL AGENT 2016-11-17 US disclosed
WO-2015197503-A1 IMIDAZO[1,2-A]PYRAZIN-1YL-BENZAMIDE COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY F. HOFFMANN-LA ROCHE AG (CH) 2015-12-30 WO disclosed
US-6083951-A FOR THE TREATMENT OF DISEASES OR MEDICAL CONDITIONS SUCH AS HYPERTENSION, PULMONARY HYPERTENSION, CARDIAC OR CEREBRAL CIRCULATORY DISEASE AND RENAL DISEASE ZENECA LIMITED (GB) 2000-07-04 US disclosed
EP-0752986-B1 N-HETEROCYCLYL SULPHONAMIDE DERIVATIVES AND THEIR USE AS ENDOTHELIN ANTAGONISTS ZENECA LTD (GB) 1999-05-19 EP disclosed
US-5861401-A TREATMENT OF CONGESTIVE HEART FAILURE ZENECA LIMITED (GB) 1999-01-19 US disclosed
EP-0752986-A1 N-HETEROCYCLYL SULPHONAMIDE DERIVATIVES AND THEIR USE AS ENDOTHELIN ANTAGONISTS ZENECA LIMITED (GB) 1997-01-15 EP disclosed
WO-1995026957-A1 N-HETEROCYCLYL SULPHONAMIDE DERIVATIVES AND THEIR USE AS ENDOTHELIN ANTAGONISTS ZENECA LIMITED (GB) 1995-10-12 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 (7 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-20250122192-A1 5-PYRIMIDINECARBOXAMIDE DERIVATIVES AND METHODS OF USING THE SAME RTCB, NSUN2, PRPF19 CCR4 4163/4885KMT2A 2669/4885HTT 3559/4885
US-20250122176-A1 INDOLE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS AR, FSHR, NR5A1 CCR4 3928/4885KMT2A 1853/4885HTT 397/4885
US-20250066389-A1 HETEROCYCLIC AMIDES AND METHODS OF USING THE SAME SNRPA, SF3B5, RBM17 CCR4 4802/4885KMT2A 2941/4885HTT 1060/4885
US-20250092021-A9 INDOLE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS AR, FSHR, NR5A1 CCR4 3928/4885KMT2A 1853/4885HTT 397/4885
US-20170197969-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY SMN1; SMN2, PYGM, GYS1 CCR4 1289/4885KMT2A 2091/4885HTT 1074/4885
US-12448368-B2 Indole compounds as androgen receptor modulators AR, FSHR, ADRB3 CCR4 3979/4885KMT2A 1758/4885HTT 278/4885
US-20160331756-A1 HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS PDK1, PDK2, PDK3 CCR4 3798/4885KMT2A 1654/4885HTT 2830/4885

“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.