SCHEMBL5467775

SCHEMBL5467775

Cn1cc(NC(=O)c2cc(N)cn2C)cc1C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ HRAS P01112 3/20 0.45
▸ ESR1 P03372 3/20 0.45
▸ ESR2 Q92731 3/20 0.45
▸ TOP1 P11387 2/20 0.45
▸ MAPT P10636 2/20 0.44
▸ POLB P06746 2/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ HIF1A Q16665 1/20 0.44
▸ P2RY12 Q9H244 1/20 0.39
▸ HPSE Q9Y251 1/20 0.38
▸ TP53 P04637 2/20 0.38
▸ THRB P10828 4/20 0.37
▸ TDP1 Q9NUW8 2/20 0.35
▸ KDM1A O60341 1/20 0.35
▸ RCOR1 Q9UKL0 1/20 0.35
▸ AR P10275 1/20 0.35
▸ CREBBP Q92793 1/20 0.35
▸ RXFP1 Q9HBX9 1/20 0.34
▸ LMNA P02545 2/20 0.34

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
SCHEMBL20485567 1.00 HRAS (0.45) HRASESR1ESR2TOP1MAPT
SCHEMBL25857874 0.88 HRAS (0.48) HRASESR1ESR2TOP1MAPT
SCHEMBL25857873 0.88 HRAS (0.45) HRASESR1ESR2TOP1MAPT
SCHEMBL14002824 0.88 HRAS (0.45) HRASESR1ESR2TOP1MAPT
SCHEMBL16062745 0.88 HRAS (0.45) HRASESR1ESR2TOP1MAPT
SCHEMBL23627239 0.88 HRAS (0.48) HRASESR1ESR2TOP1MAPT
SCHEMBL25852548 0.88 HRAS (0.45) HRASESR1ESR2TOP1MAPT
SCHEMBL18032823 0.87 HDAC1 (0.45) HRASESR1ESR2TOP1MAPT
SCHEMBL14535121 0.86 TOP1 (0.45) HRASESR1ESR2TOP1MAPT
SCHEMBL12514045 0.85 P2RY12 (0.44) HRASESR1ESR2TOP1MAPT

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023218194-A1 NUCLEIC ACID BINDERS UNIVERSITY OF STRATHCLYDE (GB) 2023-11-16 — — WO disclosed
WO-2023149487-A1 METHOD FOR PRODUCING PYRROLE-IMIDAZOLE POLYAMIDE 国立大学法人千葉大学 2023-08-10 — — WO disclosed
CN-108368006-B DNA binding agents with minor groove binding tails 得克萨斯州大学系统董事会 2023-03-07 — — CN disclosed
US-8017599-B2 Sequence selective pyrrole and imidazole polyamide metallocomplexes UNIVERSITY OF WESTERN SYDNEY (AU) 2011-09-13 — — US disclosed
US-20090247513-A1 BENZOTHIOPHENE COMPOUNDS HAVING ANTIINFECTIVE ACTIVITY GENESOFT PHARMACEUTICALS, INC. (US) 2009-10-01 — — US disclosed
US-20090247513-A1 BENZOTHIOPHENE COMPOUNDS HAVING ANTIINFECTIVE ACTIVITY GENESOFT PHARMACEUTICALS, INC. (US) 2009-10-01 — — US disclosed
US-20070265240-A1 Sequence Selective Pyrrole and Imidazole Polyamide Metallocomplexes UNIVERSITY OF WESTERN SYDNEY (AU) 2007-11-15 — — US disclosed
US-20070265240-A1 Sequence Selective Pyrrole and Imidazole Polyamide Metallocomplexes UNIVERSITY OF WESTERN SYDNEY (AU) 2007-11-15 — — US disclosed
US-20070191372-A1 Dna-targeted benzotriazine 1,4-dioxides and their use in cancer therapy AUCKLAND UNISERVICES LIMITED (NZ) 2007-08-16 — — US 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 (3 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-20070191372-A1 Dna-targeted benzotriazine 1,4-dioxides and their use in cancer therapy HIF1AN, HIF1A, HYOU1 HRAS 2342/4885ESR1 992/4885ESR2 971/4885
US-20090247513-A1 BENZOTHIOPHENE COMPOUNDS HAVING ANTIINFECTIVE ACTIVITY TOP2A, TOP1, TOP2B HRAS 4352/4885ESR1 1611/4885ESR2 1304/4885
US-20070265240-A1 Sequence Selective Pyrrole and Imidazole Polyamide Metallocomplexes POLRMT, MPI, PPIF HRAS 4085/4885ESR1 4603/4885ESR2 4820/4885

“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.

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