SCHEMBL4750491

SCHEMBL4750491

O=C1[N]c2ccc(F)cc2N1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTR5A P47898 2/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
CA7 P43166 2/20 0.36
CA9 Q16790 2/20 0.36
CA12 O43570 1/20 0.36
CA4 P22748 1/20 0.36
KDM4E B2RXH2 1/20 0.35
TGM2 P21980 1/20 0.35
MAPT P10636 3/20 0.34
KMT2A Q03164 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C19 P33261 1/20 0.34
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
PARP1 P09874 1/20 0.33
DAO P14920 1/20 0.33
PDGFRB P09619 1/20 0.33
CASP3 P42574 1/20 0.33

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
SCHEMBL4750469 0.84 CA1 (0.40) HTR5ACA1CA2CA7CA9
SCHEMBL6264592 0.84 CA1 (0.40) HTR5ACA1CA2CA7CA9
SCHEMBL4753998 0.76 CMA1 (0.43) CA1CA2CA7CA9CA12
SCHEMBL2719976 0.76 CES1 (0.44) HTR5ACA1CA2CA7CA9
SCHEMBL4750486 0.76 GRM2 (0.42) KMT2AMEN1PARP1
SCHEMBL3826696 0.75 GRM5 (0.30)
SCHEMBL7514332 0.73 LRRK2 (0.41) CA1CA2CA7CA9CA12
SCHEMBL3828426 0.72 PIK3R1 (0.36) KDM4EMAPTNPC1
SCHEMBL20505096 0.70 MAPT (0.44) KDM4EMAPTKMT2AMEN1NPC1
SCHEMBL20723 0.70 MAPT (0.44) KDM4EMAPTKMT2AMEN1NPC1

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
WO-2008146064-A1 NEW BENZOFURAN DERIVATIVES AS SELECTIVE 5HT7 RECEPTOR INHIBITORS AND PROCESS FOR THEIR PREPARATION EGIS GYÓGYSZERGYÁR (HU) 2008-12-04 WO disclosed
US-20080188478-A1 Compounds Useful In Therapy PFIZER INC. 2008-08-07 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 (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-20080188478-A1 Compounds Useful In Therapy AVPR1A, AVPR1B, AVPR2 HTR5A 164/4885CA1 1456/4885CA2 1008/4885

“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.