SCHEMBL4773626

SCHEMBL4773626

N#CCc1sccc1C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.41
MEN1 O00255 6/20 0.41
MAPT P10636 6/20 0.41
RECQL P46063 2/20 0.41
PTPN2 P17706 1/20 0.41
PTPRB P23467 1/20 0.41
PTPN6 P29350 1/20 0.41
POLB P06746 1/20 0.41
NR4A1 P22736 1/20 0.41
ESR2 Q92731 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
ALDH1A1 P00352 5/20 0.38
KDM4E B2RXH2 4/20 0.38
HPGD P15428 3/20 0.38
GAA P10253 3/20 0.38
MAPK1 P28482 2/20 0.38
GLA P06280 2/20 0.38
ABCC1 P33527 1/20 0.36
KDM6B O15054 1/20 0.35
KDM4A O75164 1/20 0.35

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
SCHEMBL10363294 0.85 MEN1 (0.41) KMT2AMEN1MAPTRECQLPTPN2
SCHEMBL26924306 0.79 KMT2A (0.47) KMT2AMEN1MAPTPOLBTDP1
SCHEMBL7119788 0.78 MEN1 (0.44) KMT2AMEN1MAPTRECQLPTPN2
SCHEMBL2778669 0.76 MEN1 (0.43) KMT2AMEN1MAPTRECQLPTPN2
SCHEMBL3810061 0.76 MEN1 (0.47) KMT2AMEN1MAPTRECQLPTPN2
SCHEMBL11443114 0.74 MEN1 (0.42) KMT2AMEN1MAPTRECQLPTPN2
SCHEMBL11394536 0.73 HNF4A (0.47) KMT2AMEN1PTPN2PTPN6ALDH1A1
SCHEMBL11231978 0.73 MEN1 (0.41) KMT2AMEN1MAPTRECQLPTPN2
SCHEMBL14039776 0.73 KMT2A (0.41) KMT2AMEN1MAPTRECQLPTPN2
SCHEMBL11630922 0.73 MEN1 (0.41) KMT2AMEN1MAPTRECQLPTPN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1020445-B1 FUSED PYRIDINE DERIVATIVES EISAI R&D MAN CO LTD (JP) 2008-08-13 EP disclosed
US-6875761-B2 Certain 1,3-disubstituted isoquinoline derivatives EISAI CO., LTD. (JP) 2005-04-05 US disclosed
US-20040204421-A1 Certain 1,3-disubstituted isoquinoline derivatives EISAI CO., LTD. 2004-10-14 US disclosed
US-6790844-B2 MUSCLE RELAXANTS; ANTISEROTONINE AGENT EISAI CO., LTD (JP) 2004-09-14 US disclosed
US-20020013460-A1 Condensed pyridine compound EISAI CO., LTD 2002-01-31 US disclosed
US-6340759-B1 ANTISPASMODIC AGENTS EISAI CO., LTD. (JP) 2002-01-22 US disclosed
EP-1020445-A1 FUSED PYRIDINE DERIVATIVES Eisai Co., Ltd. (JP) 2000-07-19 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 (2 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-20020013460-A1 Condensed pyridine compound MUSK, HTR1A, PAX3 KMT2A 1240/4885MEN1 786/4885MAPT 1892/4885
US-20040204421-A1 Certain 1,3-disubstituted isoquinoline derivatives MUSK, HTR1A, RYR1 KMT2A 1300/4885MEN1 1171/4885MAPT 3756/4885

“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.