SCHEMBL20533210

SCHEMBL20533210

Cc1noc(-c2ccc(C(=O)O)cc2)c1NC(=O)O[C@H](C)c1ccccc1

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 11/20 0.85
LPAR3 Q9UBY5 6/20 0.85
ABCC3 O15438 1/20 0.71
ABCC4 O15439 1/20 0.71
ABCB11 O95342 1/20 0.71
CYP2C8 P10632 1/20 0.71
CYP2C9 P11712 1/20 0.71
ABCB4 P21439 1/20 0.71
ABCC2 Q92887 1/20 0.71
SLCO1B3 Q9NPD5 1/20 0.71
SLCO1B1 Q9Y6L6 1/20 0.71
LPAR2 Q9HBW0 2/20 0.58
MAPT P10636 2/20 0.46
KDM4E B2RXH2 1/20 0.46
IP6K1 Q92551 4/20 0.40
IP6K3 Q96PC2 4/20 0.40
IP6K2 Q9UHH9 4/20 0.40
HRH1 P35367 1/20 0.40
CSNK2A2 P19784 1/20 0.40
CSNK2A1 P68400 1/20 0.40

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
SCHEMBL16061139 1.00 LPAR1 (0.85) LPAR1LPAR3ABCC3ABCC4ABCB11
SCHEMBL16061141 1.00 LPAR1 (0.85) LPAR1LPAR3ABCC3ABCC4ABCB11
SCHEMBL2294221 0.99 LPAR1 (0.83) LPAR1LPAR3ABCC3ABCC4ABCB11
SCHEMBL2294214 0.99 LPAR1 (0.83) LPAR1LPAR3ABCC3ABCC4ABCB11
SCHEMBL15897743 0.94 LPAR1 (0.76) LPAR1LPAR3ABCC3ABCC4ABCB11
SCHEMBL12153260 0.92 LPAR1 (0.95) LPAR1LPAR3ABCC3ABCC4ABCB11
SCHEMBL12153261 0.92 LPAR1 (0.95) LPAR1LPAR3ABCC3ABCC4ABCB11
SCHEMBL2780170 0.92 LPAR1 (1.00) LPAR1LPAR3ABCC3ABCC4ABCB11
SCHEMBL22026737 0.92 LPAR1 (0.82) LPAR1LPAR3ABCC3ABCC4ABCB11
SCHEMBL16060861 0.92 LPAR1 (0.71) LPAR1LPAR3ABCC3ABCC4ABCB11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11427552-B2 Heterocyclic compounds useful in the treatment of disease EPIGEN BIOSCIENCES, INC. (US) 2022-08-30 US disclosed
CN-105142635-B Heterocyclic compounds useful for the treatment of diseases 艾匹根生物技术有限公司 2021-07-27 CN disclosed
US-20200181099-A1 Heterocyclic Compounds Useful In The Treatment Of Disease EPIGEN BIOSCIENCES, INC. (US) 2020-06-11 US disclosed
US-20180297962-A1 Heterocyclic Compounds Useful In The Treatment of Disease EPIGEN BIOSCIENCES, INC. (US) 2018-10-18 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 (3 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-20180297962-A1 Heterocyclic Compounds Useful In The Treatment of Disease LPAR1, LPAR4, LPAR2 LPAR1 1/4885LPAR3 4/4885ABCC3 2420/4885
US-11427552-B2 Heterocyclic compounds useful in the treatment of disease LPAR1, LPAR4, LPAR3 LPAR1 1/4885LPAR3 3/4885ABCC3 2687/4885
US-20200181099-A1 Heterocyclic Compounds Useful In The Treatment Of Disease LPAR1, LPAR4, LPAR3 LPAR1 1/4885LPAR3 3/4885ABCC3 2687/4885

“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.