SCHEMBL6539735

SCHEMBL6539735

COc1ccc(C2=C(c3ccc(=O)n(C(C)C)n3)CCC(=O)N2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
HTR2B P41595 1/20 0.41
HRH3 Q9Y5N1 3/20 0.40
TDP1 Q9NUW8 1/20 0.37
POLB P06746 2/20 0.37
KDM4E B2RXH2 1/20 0.37
USP2 O75604 1/20 0.37
TSHR P16473 1/20 0.37
RECQL P46063 1/20 0.37
HSD17B10 Q99714 1/20 0.37
CRBN Q96SW2 3/20 0.36
DDB1 Q16531 2/20 0.36
LMNA P02545 2/20 0.36
BMPR1B O00238 1/20 0.36
BMPR1A P36894 1/20 0.36
TGFBR1 P36897 1/20 0.36
ACVRL1 P37023 1/20 0.36
ACVR1 Q04771 1/20 0.36
GAA P10253 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
SCHEMBL6538291 0.87 BRD4 (0.39) POLBCRBNDDB1GAAPIK3CD
SCHEMBL6539242 0.86 HTR2A (0.39) HTR2AHTR2CHTR2BHRH3CRBN
SCHEMBL6539323 0.86 DDB1 (0.40) HTR2AHTR2CHTR2BHRH3POLB
SCHEMBL6539109 0.80 CRBN (0.38) USP2CRBNDDB1
SCHEMBL6539443 0.75 CRBN (0.34) HRH3TDP1TSHRCRBNDDB1
SCHEMBL6539121 0.71 PDE10A (0.45) HTR2AHTR2CHTR2BHRH3TDP1
SCHEMBL6539184 0.69 DDB1 (0.36) HTR2AHTR2CHTR2BTDP1POLB
SCHEMBL6538928 0.69 ADORA2A (0.45) CRBNDDB1BMPR1BBMPR1ATGFBR1
SCHEMBL6538043 0.68 CDK4 (0.39) HTR2AHTR2CHTR2BHRH3TDP1
SCHEMBL6538762 0.68 TP53 (0.38) POLBKDM4EHSD17B10LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040067955-A1 Pyridazinone compound and pharmaceutical use thereof FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2004-04-08 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-20040067955-A1 Pyridazinone compound and pharmaceutical use thereof ADORA1, ADORA2A, P2RX5 HTR2A 75/4885HTR2C 72/4885HTR2B 102/4885

“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.