SCHEMBL21481750

SCHEMBL21481750

COc1ccc(-c2ccc(Cn3ccc4c(F)ccc(C(=O)NC5CCC(C(=O)O)CC5)c43)cc2)cn1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 1/20 0.42
▸ CNR2 P34972 7/20 0.41
▸ CNR1 P21554 5/20 0.41
▸ CSNK2A2 P19784 1/20 0.40
▸ CSNK2A1 P68400 1/20 0.40
▸ EGLN1 Q9GZT9 1/20 0.38
▸ RIPK2 O43353 3/20 0.37
▸ MCHR1 Q99705 2/20 0.37
▸ BMPR1B O00238 2/20 0.36
▸ BMPR1A P36894 2/20 0.36
▸ TGFBR1 P36897 2/20 0.36
▸ ACVRL1 P37023 2/20 0.36
▸ ACVR1 Q04771 2/20 0.36
▸ CHRM1 P11229 1/20 0.36
▸ PDE5A O76074 1/20 0.36
▸ FFAR2 O15552 1/20 0.36

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
SCHEMBL21485593 0.91 CNR2 (0.40) KDRCNR2CNR1EGLN1RIPK2
SCHEMBL21481855 0.89 CNR2 (0.51) CNR2CNR1MCHR1CHRM1
SCHEMBL21481779 0.89 CNR2 (0.42) CNR2CNR1CSNK2A2CSNK2A1RIPK2
SCHEMBL21506548 0.88 HSD11B1 (0.41) CNR2CNR1EGLN1BMPR1BBMPR1A
SCHEMBL21481774 0.86 CNR1 (0.43) CNR2CNR1MCHR1
SCHEMBL26620644 0.86 CYP3A4 (0.39) KDRCNR2CNR1CSNK2A2CSNK2A1
SCHEMBL21481825 0.86 CNR2 (0.47) CNR2CNR1EGLN1MCHR1CHRM1
SCHEMBL21482092 0.86 NAAA (0.43) CNR2CNR1MCHR1PDE5A
SCHEMBL21481677 0.85 CNR2 (0.41) CNR2CNR1EGLN1
SCHEMBL31203690 0.85 CNR2 (0.36) KDRCNR2CNR1EGLN1CHRM1

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-10968201-B2 Bicyclic carboxamides and methods of use thereof TEMPEST THERAPEUTICS, INC. (US) 2021-04-06 — — US disclosed
US-20190315712-A1 BICYCLIC CARBOXAMIDES AND METHODS OF USE THEREOF TEMPEST THERAPEUTICS, INC. 2019-10-17 — — 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 (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-10968201-B2 Bicyclic carboxamides and methods of use thereof PTGER4, PTGER2, CNR2 KDR 2571/4885CNR2 3/4885CNR1 6/4885
US-20190315712-A1 BICYCLIC CARBOXAMIDES AND METHODS OF USE THEREOF PTGER4, PTGER2, CNR2 KDR 2571/4885CNR2 3/4885CNR1 6/4885

“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.

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