SCHEMBL645457

SCHEMBL645457

Cn1ccc(-c2ccc(Br)cc2)n1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.64
KMT2A Q03164 2/20 0.63
SCN4A P35499 1/20 0.53
CYP19A1 P11511 1/20 0.51
KCNH2 Q12809 1/20 0.47
PIK3CD O00329 1/20 0.42
PIP5K1C O60331 1/20 0.42
PIK3CA P42336 1/20 0.42
PIK3CB P42338 1/20 0.42
PI4KA P42356 1/20 0.42
PIK3CG P48736 1/20 0.42
PI4KB Q9UBF8 1/20 0.42
NPC1 O15118 6/20 0.42
RAB9A P51151 6/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
KDM4E B2RXH2 4/20 0.41
POLB P06746 1/20 0.41
APP P05067 1/20 0.41
PAX8 Q06710 1/20 0.41
MKNK1 Q9BUB5 1/20 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
SCHEMBL12319225 0.80 KEAP1 (0.67) KEAP1KMT2ASCN4ACYP19A1PIK3CD
SCHEMBL989300 0.78 SCN4A (0.79) KEAP1KMT2ASCN4ACYP19A1PIK3CD
SCHEMBL19356896 0.78 KEAP1 (0.64) KEAP1KMT2ASCN4ACYP19A1PIK3CD
SCHEMBL15885670 0.78 KEAP1 (0.64) KEAP1KMT2ASCN4ACYP19A1PIK3CD
SCHEMBL2615403 0.78 KEAP1 (0.64) KEAP1KMT2ASCN4ACYP19A1KCNH2
SCHEMBL1160801 0.78 KEAP1 (1.00) KEAP1KMT2ASCN4ACYP19A1PIK3CD
SCHEMBL17201055 0.78 KEAP1 (0.58) KEAP1KMT2ASCN4ACYP19A1KCNH2
SCHEMBL1155310 0.77 KMT2A (1.00) KEAP1KMT2ASCN4ACYP19A1PIK3CD
SCHEMBL24724114 0.76 KEAP1 (0.56) KEAP1KMT2ASCN4ACYP19A1KCNH2
SCHEMBL2658312 0.76 KMT2A (0.60) KEAP1KMT2ASCN4AKCNH2PIK3CD

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-4648853-A1 TARGETED DEGRADATION OF VAV1 Monte Rosa Therapeutics AG (CH) 2025-11-19 EP disclosed
US-20250205219-A1 TARGETED DEGRADATION OF VAV1 MONTE ROSA THERAPEUTICS AG (CH) 2025-06-26 US disclosed
US-12257247-B2 Targeted degradation of VAV1 MONTE ROSA THERAPEUTICS AG (CH) 2025-03-25 US disclosed
EP-4444714-A1 FUSED HETEROCYCLIC COMPOUNDS AS PI3KALPHA INHIBITORS Nanjing Zenshine Pharmaceuticals Co., Ltd. (CN) 2024-10-16 EP disclosed
CN-118742545-A Fused heterocyclic compounds as PI3K alpha inhibitors 南京征祥医药有限公司 2024-10-01 CN disclosed
US-20240285604-A1 TARGETED DEGRADATION OF VAV1 MONTE ROSA THERAPEUTICS AG (CH) 2024-08-29 US disclosed
WO-2024151547-A1 TARGETED DEGRADATION OF VAV1 MONTE ROSA THERAPEUTICS, INC. (US) 2024-07-18 WO disclosed
US-11802120-B2 Fused cyclic urea derivatives as CRHR2 antagonist RAQUALIA PHARMA INC. (JP) 2023-10-31 US disclosed
US-11802120-B2 Fused cyclic urea derivatives as CRHR2 antagonist RAQUALIA PHARMA INC. (JP) 2023-10-31 US disclosed
WO-2023122778-A1 PYRIDAZINONE DERIVATIVES USEFUL AS T CELL ACTIVATORS GOSSAMER BIO SERVICES, INC. (US) 2023-06-29 WO disclosed
US-20090156560-A1 TISSUE NON-SPECIFIC ALKALINE PHOSPHATASE INHIBITORS AND USES THEREOF FOR TREATING VASCULAR CALCIFICATION SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE 2009-06-18 US disclosed
US-7425555-B2 Heteroaryl substituted biphenyl derivatives as p38 kinase inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2008-09-16 US disclosed
WO-2008065493-A1 PYRAZOLE ANALOGS PFIZER PRODUCTS INC. (US) 2008-06-05 WO disclosed
EP-1499600-B1 HETEROARYL SUBSTITUTED BIPHENYL DERIVATIVES AS P38 KINASE INHIBITORS SMITHKLINE BEECHAM CORP (US) 2007-07-25 EP disclosed
US-20060089393-A1 Heteroaryl substituted biphenyl derivatives as p38 kinase inhibitors GLAXOSMITHKLINE LLC 2006-04-27 US disclosed
EP-1534700-A1 NOVEL THIOPHENE DERIVATIVES, PREPARATION METHOD THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME WARNER-LAMBERT COMPANY LLC (US) 2005-06-01 EP disclosed
US-20040072871-A1 Novel thiophene derivatives, their process of preparation and the pharmaceutical compositions which comprise them WARNER-LAMBERT COMPANY LLC 2004-04-15 US disclosed
WO-2004018448-A1 NOVEL THIOPHENE DERIVATIVES, PREPARATION METHOD THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME WARNER-LAMBERT COMPANY LLC (US) 2004-03-04 WO disclosed
EP-1394159-A1 New thiophene derivatives, process for their preparation and pharmaceutical compositions containing them Warner-Lambert Company LLC (US) 2004-03-03 EP disclosed
WO-1994015920-A1 BENZANILIDE DERIVATIVES AS 5-HT1D-ANTAGONISTS GLAXO GROUP LIMITED (GB) 1994-07-21 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-20060089393-A1 Heteroaryl substituted biphenyl derivatives as p38 kinase inhibitors MAPK1, MAPK7, MAP3K1 KEAP1 1886/4885KMT2A 3587/4885SCN4A 4037/4885
US-20240285604-A1 TARGETED DEGRADATION OF VAV1 VAV1, KRAS, CBL KEAP1 701/4885KMT2A 1159/4885SCN4A 2668/4885
US-12257247-B2 Targeted degradation of VAV1 VAV1, KRAS, CBL KEAP1 701/4885KMT2A 1159/4885SCN4A 2668/4885
US-20090156560-A1 TISSUE NON-SPECIFIC ALKALINE PHOSPHATASE INHIBITORS AND USES THEREOF FOR TREATING VASCULAR CALCIFICATION ALPL, CNDP2, ALPI KEAP1 2903/4885KMT2A 2396/4885SCN4A 3782/4885
US-20040072871-A1 Novel thiophene derivatives, their process of preparation and the pharmaceutical compositions which comprise them MMP11, MMP13, CBR1 KEAP1 2893/4885KMT2A 4610/4885SCN4A 429/4885
US-11802120-B2 Fused cyclic urea derivatives as CRHR2 antagonist CRHR2, CRHR1, CRH KEAP1 629/4885KMT2A 4119/4885SCN4A 4477/4885
US-20250205219-A1 TARGETED DEGRADATION OF VAV1 VAV1, KRAS, CBL KEAP1 701/4885KMT2A 1159/4885SCN4A 2668/4885

“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.