SCHEMBL4074633

SCHEMBL4074633

CCCc1cc(C)c(C#N)c(OC)n1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RECQL P46063 2/20 0.59
MAPK1 P28482 2/20 0.44
POLB P06746 1/20 0.44
TSHR P16473 1/20 0.44
SQOR Q9Y6N5 7/20 0.43
CTSK P43235 5/20 0.43
BCAT2 O15382 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C19 P33261 1/20 0.39
CTSS P25774 3/20 0.39
MAPK8 P45983 1/20 0.39
MAPK9 P45984 1/20 0.39
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL2592972 0.83 RECQL (0.61) RECQLMAPK1POLBTSHRSQOR
SCHEMBL23895347 0.83 RECQL (0.61) RECQLMAPK1POLBTSHRSQOR
SCHEMBL4065434 0.80 SQOR (0.43) RECQLPOLBTSHRSQORCTSK
SCHEMBL31128540 0.78 SQOR (0.56) MAPK1POLBTSHRSQORCTSK
SCHEMBL2673753 0.76 RECQL (0.71) RECQLMAPK1POLBTSHRSMN1; SMN2
SCHEMBL2594001 0.76 RECQL (0.52) RECQLMAPK1POLBTSHRSQOR
SCHEMBL4065725 0.76 MAPK8 (0.43) RECQLSQORCTSKBCAT2CTSS
SCHEMBL5377959 0.75 RECQL (1.00) RECQLMAPK1POLBTSHRSQOR
SCHEMBL11751937 0.74 RECQL (0.58) RECQLMAPK1POLBTSHRSQOR
SCHEMBL17163957 0.73 RECQL (0.67) RECQLMAPK1POLBTSHRSQOR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7601736-B2 Such as 3,4-dihydro-pyrano[3,4-c]pyridine-1-on; cytokine suppressive antiinflammatory drugs; analgesics SK CHEMICALS CO., LTD. (KR) 2009-10-13 US disclosed
EP-1706412-A4 NOVEL PYRIDINE DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND A PHARMACEUTICAL COMPOSITION CONTAINING THE SAME SK CHEMICALS CO LTD (KR) 2009-03-18 EP disclosed
US-20070254909-A1 Novel Pyridine Derivatives, a Process for Their Preparation and a Pharmaceutical Composition Containing the Same SK CHEMICALS CO., LTD. (KR) 2007-11-01 US disclosed
EP-1706412-A1 NOVEL PYRIDINE DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND A PHARMACEUTICAL COMPOSITION CONTAINING THE SAME SK Chemicals, Co., Ltd. (KR) 2006-10-04 EP disclosed
WO-2005063768-A1 NOVEL PYRIDINE DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND A PHARMACEUTICAL COMPOSITION CONTAINING THE SAME SK CHEMICALS, CO., LTD. (KR) 2005-07-14 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-20070254909-A1 Novel Pyridine Derivatives, a Process for Their Preparation and a Pharmaceutical Composition Containing the Same IL5, IL1B, P2RY4 RECQL 3534/4885MAPK1 615/4885POLB 4143/4885

“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.