SCHEMBL27285183

SCHEMBL27285183

C[C@@H](Cc1cc(Cl)ccc1-c1ccccn1)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.43
PPARD Q03181 1/20 0.43
PPARA Q07869 1/20 0.43
GRM5 P41594 3/20 0.41
CYP1A2 P05177 1/20 0.40
PTPRA P18433 1/20 0.40
MAPT P10636 2/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
ALDH1A1 P00352 1/20 0.39
PKM P14618 1/20 0.39
KMT2A Q03164 1/20 0.39
MME P08473 1/20 0.39
KDM4E B2RXH2 1/20 0.39
APAF1 O14727 1/20 0.39
POLB P06746 1/20 0.39
RECQL P46063 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
PTGER1 P34995 1/20 0.38
PTGER4 P35408 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
SCHEMBL7571404 0.84 PTGER1 (0.48) CYP1A2PTPRAMAPTKMT2AKDM4E
SCHEMBL18710702 0.80 NPC1 (0.47) GRM5CYP1A2MAPTNPC1RAB9A
SCHEMBL27285205 0.74 AAK1 (0.49) PPARGPPARDPPARAGRM5CYP1A2
SCHEMBL21056985 0.72 TSHR (0.56) PPARGPPARDPPARANPC1RAB9A
SCHEMBL21056989 0.72 TSHR (0.56) PPARGPPARDPPARANPC1RAB9A
SCHEMBL30640053 0.72 TSHR (0.56) PPARGPPARDPPARANPC1RAB9A
SCHEMBL28456431 0.72 NPC1 (0.43) GRM5CYP1A2MAPTNPC1RAB9A
SCHEMBL13002972 0.71 KMO (0.42) PPARACYP1A2MAPTRAB9AALDH1A1
SCHEMBL12713189 0.71 PPARA (0.43) PPARGPPARACYP1A2MAPTRAB9A
SCHEMBL17661920 0.71 NPC1 (0.50) GRM5CYP1A2MAPTNPC1RAB9A

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-20240218021-A1 CYCLIN INHIBITORS CIRCLE PHARMA, INC. 2024-07-04 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-20240218021-A1 CYCLIN INHIBITORS CCNI, CCNC, CDK2 PPARG 1553/4885PPARD 2693/4885PPARA 2803/4885

“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.