SCHEMBL14969642

SCHEMBL14969642

Cc1cc(CO)nn1Cc1cc(Cl)ccc1O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 2/20 0.45
MEN1 O00255 1/20 0.45
SLC22A1 O15245 1/20 0.45
USP2 O75604 1/20 0.45
LMNA P02545 1/20 0.45
HSP90AA1 P07900 1/20 0.45
CYP3A4 P08684 1/20 0.45
MAPT P10636 1/20 0.45
HSPD1 P10809 1/20 0.45
HSPA5 P11021 1/20 0.45
IDO1 P14902 1/20 0.45
HPGD P15428 1/20 0.45
ALOX15 P16050 1/20 0.45
ALOX12 P18054 1/20 0.45
CASP1 P29466 1/20 0.45
HTT P42858 1/20 0.45
BLM P54132 1/20 0.45
HSPE1 P61604 1/20 0.45
KMT2A Q03164 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL253562 0.80 PTGER1 (0.44) PTGER1
SCHEMBL15880425 0.80 PTGER1 (0.64) PTGER1
SCHEMBL3435608 0.77 PTGER1 (0.61) PTGER1CYP2C9CYP2C19
SCHEMBL252003 0.76 PTGER1 (0.51) PTGER1
SCHEMBL251373 0.76 PTGER1 (0.71) PTGER1CYP2C9CYP2C19
SCHEMBL15052352 0.73 PTGER1 (0.45) PTGER1
SCHEMBL4085172 0.72 PTGER1 (0.67) LMNAKMT2APTGER1CYP2C9
SCHEMBL3098637 0.72 KMT2A (0.49) HIF1AMEN1LMNACYP3A4MAPT
SCHEMBL14924173 0.72 GRN (0.49) MEN1LMNAKMT2AALDH1A1RAB9A
SCHEMBL4089795 0.71 PTGER1 (0.74) PTGER1CYP2C9CYP2C19

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-20130131135-A1 COMPOUNDS ACT AT MULTIPLE PROSTAGLANDIN RECEPTORS GIVING A GENERAL ANTI-INFLAMMATORY RESPONSE ALLERGAN, INC. (US) 2013-05-23 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-20130131135-A1 COMPOUNDS ACT AT MULTIPLE PROSTAGLANDIN RECEPTORS GIVING A GENERAL ANTI-INFLAMMATORY RESPONSE PTGER1, PTGER4, CNR1 HIF1A 360/4885MEN1 4786/4885SLC22A1 3261/4885

“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.