SCHEMBL3090628

SCHEMBL3090628

Brc1nc2c(s1)CCCC2

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK1 Q15118 3/20 0.56
FBP1 P09467 2/20 0.56
APOBEC3A P31941 1/20 0.56
APOBEC3G Q9HC16 1/20 0.56
ADRA2A P08913 4/20 0.47
ADRA2B P18089 4/20 0.47
ADRA2C P18825 4/20 0.47
SMN1; SMN2 Q16637 6/20 0.42
ALDH1A1 P00352 4/20 0.42
LMNA P02545 3/20 0.42
HTT P42858 2/20 0.42
NPC1 O15118 6/20 0.42
RAB9A P51151 6/20 0.42
TSHR P16473 1/20 0.42
MAPT P10636 5/20 0.41
HPGD P15428 3/20 0.41
NFKB1 P19838 2/20 0.41
NFKB2 Q00653 2/20 0.41
RELA Q04206 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41

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
SCHEMBL17028600 0.98 APOBEC3A (0.59) PDK1FBP1APOBEC3AAPOBEC3GADRA2A
SCHEMBL2147098 0.95
SCHEMBL7325816 0.75 APOBEC3A (0.61) PDK1FBP1APOBEC3AAPOBEC3GADRA2A
SCHEMBL15007108 0.75 DRD2 (0.33) PDK1FBP1APOBEC3AAPOBEC3G
SCHEMBL3867320 0.73 PDK1 (0.54) PDK1FBP1APOBEC3AAPOBEC3GADRA2A
SCHEMBL171200 0.73 PDK1 (0.54) PDK1FBP1APOBEC3AAPOBEC3GADRA2A
SCHEMBL2749715 0.73 PDK1 (0.54) PDK1FBP1APOBEC3AAPOBEC3GADRA2A
SCHEMBL12210600 0.73 PDK1 (0.54) PDK1FBP1APOBEC3AAPOBEC3GADRA2A
SCHEMBL10965367 0.73 APOBEC3A (0.59) PDK1FBP1APOBEC3AAPOBEC3GADRA2A
SCHEMBL558522 0.73 APOBEC3A (0.95) PDK1FBP1APOBEC3AAPOBEC3GADRA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4658656-A1 CONDENSED HETEROCYCLIC COMPOUNDS AS INHIBITOR OF DIACYLGLYCEROL KINASES Beone Medicines I GmbH (CH) 2025-12-10 EP disclosed
US-20250346597-A1 CONDENSED HETEROCYCLIC COMPOUNDS AS INHIBITOR OF DIACYLGLYCEROL KINASES BEONE MEDICINES I GMBH (CH) 2025-11-13 US disclosed
EP-4568666-A1 PHARMACEUTICAL COMPOUNDS FOR THE TREATMENT OF COMPLEMENT MEDIATED DISORDERS Alexion Pharmaceuticals, Inc. (US) 2025-06-18 EP disclosed
US-20250179061-A1 RIP1 MODULATORS, PREPARATIONS, AND USES THEREOF Sironax Ltd. (KY) 2025-06-05 US disclosed
CN-119768164-A Pharmaceutical compounds for treating complement-mediated disorders 阿雷克森制药公司 2025-04-04 CN disclosed
EP-4486743-A1 RIP1 MODULATORS, PREPARATIONS, AND USES THEREOF Sironax Ltd (KY) 2025-01-08 EP disclosed
CN-118765280-A RIP1 modulators, their preparation and use 维泰瑞隆有限公司 2024-10-11 CN disclosed
US-12060347-B2 Bicyclic heteroaryl substituted compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2024-08-13 US disclosed
WO-2024160276-A1 CONDENSED HETEROCYCLIC COMPOUNDS AS INHIBITOR OF DIACYLGLYCEROL KINASES BEIGENE, LTD. (KY) 2024-08-08 WO disclosed
WO-2024035686-A1 PHARMACEUTICAL COMPOUNDS FOR THE TREATMENT OF COMPLEMENT MEDIATED DISORDERS ALEXION PHARMACEUTICALS, INC. (US) 2024-02-15 WO disclosed
WO-2008137816-A2 TRICYCLIC COMPOUNDS AS MATRIX METALLOPROTEINASE INHIBITORS WYETH (US) 2008-11-13 WO disclosed
US-20070232591-A1 Piperazinyl oxoalkyl tetrahydroisoquinolines and related analogues NEUROGEN CORPORATION 2007-10-04 US disclosed
US-7214801-B2 Condensation reagents and a process for their preparation LANXESS DEUTSCHLAND GMBH (DE) 2007-05-08 US disclosed
US-7214801-B2 Condensation reagents and a process for their preparation LANXESS DEUTSCHLAND GMBH (DE) 2007-05-08 US disclosed
US-7214801-B2 Condensation reagents and a process for their preparation LANXESS DEUTSCHLAND GMBH (DE) 2007-05-08 US disclosed
US-7064216-B2 Condensation reagents and a process for their preparation BAYER AKTIENGESELLSCHAFT (DE) 2006-06-20 US disclosed
EP-1216997-B1 2-bromo/chloro-thiazolium salts and their use as condensation agents LANXESS DEUTSCHLAND GMBH (DE) 2006-02-15 EP disclosed
US-20050267174-A1 Condensation reagents and a process for their preparation RUDOLPH JOACHIM 2005-12-01 US disclosed
US-20020156287-A1 Condensation reagents and a process for their preparation LANXESS DEUTSCHLAND GMBH (DE) 2002-10-24 US disclosed
EP-1216997-A2 2-bromo/chloro-thiazolium salts and their use as condensation agents BAYER AG (DE) 2002-06-26 EP 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 (6 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-20050267174-A1 Condensation reagents and a process for their preparation C9, QPCT, RCC1 PDK1 2160/4885FBP1 3550/4885APOBEC3A 4156/4885
US-12060347-B2 Bicyclic heteroaryl substituted compounds F2, F2RL3, F12 PDK1 951/4885FBP1 2938/4885APOBEC3A 1982/4885
US-20070232591-A1 Piperazinyl oxoalkyl tetrahydroisoquinolines and related analogues HRH3, HRH4, HRH1 PDK1 1536/4885FBP1 4272/4885APOBEC3A 3842/4885
US-20250179061-A1 RIP1 MODULATORS, PREPARATIONS, AND USES THEREOF RIPK1, RIPK2, RIPK3 PDK1 649/4885FBP1 378/4885APOBEC3A 4509/4885
US-20250346597-A1 CONDENSED HETEROCYCLIC COMPOUNDS AS INHIBITOR OF DIACYLGLYCEROL KINASES DGKG, DGKA, DGKK PDK1 504/4885FBP1 2975/4885APOBEC3A 3476/4885
US-20020156287-A1 Condensation reagents and a process for their preparation RCC1, C9, CCNT1 PDK1 3160/4885FBP1 2018/4885APOBEC3A 4175/4885

“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.