SCHEMBL971141

SCHEMBL971141

CCCc1n[nH]cc1C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 5/20 0.42
KDM5B Q9UGL1 4/20 0.41
KDM5A P29375 1/20 0.41
GABRP O00591 3/20 0.38
GABRD O14764 3/20 0.38
GABRA1 P14867 3/20 0.38
GABRB1 P18505 3/20 0.38
GABRG2 P18507 3/20 0.38
GABRB3 P28472 3/20 0.38
GABRA5 P31644 3/20 0.38
GABRA3 P34903 3/20 0.38
GABRA2 P47869 3/20 0.38
GABRB2 P47870 3/20 0.38
GABRA4 P48169 3/20 0.38
GABRE P78334 3/20 0.38
GABRA6 Q16445 3/20 0.38
GABRG1 Q8N1C3 3/20 0.38
GABRG3 Q99928 3/20 0.38
GABRQ Q9UN88 3/20 0.38
KDM4E B2RXH2 1/20 0.37

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
SCHEMBL20267445 0.89 GABRP (0.50) HCAR2KDM5BGABRPGABRDGABRA1
SCHEMBL15309721 0.85 HSP90AA1 (0.36) HCAR2HSP90AA1CCNE2CCNE1CDK2
SCHEMBL553835 0.85 GABRP (0.44) HCAR2KDM5BKDM5AGABRPGABRD
SCHEMBL22637695 0.84 HCAR2 (0.49) HCAR2KDM5BKDM5AGABRPGABRD
SCHEMBL716791 0.82 TSHR (0.38) KDM4EHSP90AA1CCNE2CCNE1CDK2
SCHEMBL15309704 0.81 HSP90AA1 (0.33) HCAR2KDM5BKDM5AHSP90AA1CCNE2
SCHEMBL2820788 0.81 HSP90AA1 (0.52) KDM4EHSP90AA1
SCHEMBL25352337 0.80 PRKAB2 (0.35) HCAR2KDM5BKDM5AGABRPGABRD
SCHEMBL5951752 0.79 HCAR2 (0.37) HCAR2KDM5BKDM5AGABRPGABRD
SCHEMBL20524643 0.78 HCAR2 (0.46) HCAR2KDM5BKDM5AGABRPGABRD

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-7875745-B2 {1-[(2S,3S)-2-(2,3-dihydro-1H-inden-2-ylmethyl)-3-(3,5-dimethoxy-4- methylphenyl)-3-hydroxylpropyl]-1H-pyrrol-3-yl}acetic acid; for urinary system disease selected from the group of prostatic hypertrophy, neurogenic bladder dysfunction disease, dysuria, pollakiuria, night urination and urodynia ONO PHARMACEUTICAL CO., LTD. (JP) 2011-01-25 US disclosed
US-20070149595-A1 Compounds having lysophosphatidic acid receptor antagonism and uses thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2007-06-28 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-20070149595-A1 Compounds having lysophosphatidic acid receptor antagonism and uses thereof LPAR2, LPAR1, LPAR5 HCAR2 30/4885KDM5B 1786/4885KDM5A 1496/4885

“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.