SCHEMBL6448346

SCHEMBL6448346

COc1ccc(O)c(-c2ccn(Cc3ccccn3)n2)c1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.46
SYK P43405 4/20 0.45
PLA2G2A P14555 2/20 0.41
FFAR1 O14842 2/20 0.41
GRIN1 Q05586 1/20 0.40
GRIN2B Q13224 1/20 0.40
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
ALOX15 P16050 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
AURKB Q96GD4 2/20 0.39
INCENP Q9NQS7 2/20 0.39
IDH1 O75874 1/20 0.39
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 1/20 0.39
GLA P06280 1/20 0.39
POLB P06746 1/20 0.39

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
SCHEMBL6449630 0.82 SYK (0.54) CYP19A1SYKKMT2AAURKBINCENP
SCHEMBL6450412 0.81 GUSB (0.43) CYP19A1KMT2AMEN1ALOX15KDM4E
SCHEMBL6449917 0.78 MAPT (0.50) CYP19A1KMT2AMEN1ALOX15L3MBTL1
SCHEMBL6448824 0.76 GRIN1 (0.46) CYP19A1SYKPLA2G2AGRIN1GRIN2B
SCHEMBL6454652 0.74 BRS3 (0.40) CYP19A1KMT2AMEN1ALOX15KDM4E
SCHEMBL5216458 0.72 KDM4E (0.47) KMT2AMEN1ALOX15L3MBTL1KDM4E
SCHEMBL29167678 0.71 SYK (0.48) CYP19A1SYKKMT2AMEN1ALOX15
SCHEMBL6454162 0.71 CYP19A1 (0.46) CYP19A1KMT2AMEN1ALOX15L3MBTL1
SCHEMBL6448695 0.71 MAPT (0.50) CYP19A1SYKKMT2AMEN1ALOX15
SCHEMBL17239424 0.70 ALDH1A1 (0.49) KMT2AMEN1L3MBTL1KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050075375-A1 Heterocyclic compounds for treating hepatitis C virus ANADYS PHARMACEUTICALS, INC. (US) 2005-04-07 US disclosed
WO-2004110351-A2 HETEROCYCLIC COMPOUNDS FOR TREATING HEPATITIS C VIRUS ANADYS PHARMACEUTICALS, INC. (US) 2004-12-23 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 (1 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-20050075375-A1 Heterocyclic compounds for treating hepatitis C virus HAVCR2, HCCS, LIPC CYP19A1 523/4885SYK 4094/4885PLA2G2A 3540/4885

“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.