SCHEMBL1508764

SCHEMBL1508764

CCc1cccc2c1CCC2O

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLL Q9UGP5 1/20 0.43
FFAR1 O14842 1/20 0.43
GABRA1 P14867 2/20 0.41
GABRB2 P47870 2/20 0.41
KMT2A Q03164 1/20 0.40
S1PR1 P21453 7/20 0.39
S1PR2 O95136 1/20 0.39
S1PR4 O95977 1/20 0.39
S1PR3 Q99500 1/20 0.39
S1PR5 Q9H228 1/20 0.39
ADRA1A P35348 3/20 0.36
OPRL1 P41146 1/20 0.36
KCNH2 Q12809 1/20 0.36
ACHE P22303 1/20 0.35

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
SCHEMBL1508337 1.00 POLL (0.43) POLLFFAR1GABRA1GABRB2KMT2A
SCHEMBL17571276 1.00 POLL (0.43) POLLFFAR1GABRA1GABRB2KMT2A
SCHEMBL9456077 0.86 HTR2A (0.43) POLLKMT2AS1PR1S1PR2S1PR4
SCHEMBL9278331 0.81 RIPK1 (0.39) POLLKMT2AS1PR1S1PR2S1PR4
SCHEMBL28950294 0.81 KMT2A (0.38) POLLFFAR1KMT2AS1PR1S1PR2
SCHEMBL9506611 0.81 TBXA2R (0.42) POLLFFAR1KMT2AADRA1A
SCHEMBL9455939 0.80 KMT2A (0.37) POLLKMT2AS1PR1S1PR2S1PR4
SCHEMBL1150895 0.79 ACHE (0.50) FFAR1GABRA1GABRB2KMT2AS1PR1
SCHEMBL9455921 0.78 GABRA1 (0.42) POLLGABRA1GABRB2KMT2AADRA1A
SCHEMBL9456057 0.78 KMT2A (0.46) POLLKMT2AS1PR1S1PR2S1PR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240025918-A1 KRAS G12D Inhibitors JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2024-01-25 US disclosed
EP-2289868-B1 CARBOXYLIC ACID COMPOUND DAIICHI SANKYO CO LTD (JP) 2014-08-13 EP disclosed
US-8222281-B2 Carboxylic acid compound DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-07-17 US disclosed
CN-102076650-A Carboxylic acid compound DAIICHI SANKYO CO LTD 2011-05-25 CN disclosed
US-20110053974-A1 CARBOXYLIC ACID COMPOUND DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-03-03 US disclosed
EP-2289868-A1 CARBOXYLIC ACID COMPOUND Daiichi Sankyo Company, Limited (JP) 2011-03-02 EP 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-20110053974-A1 CARBOXYLIC ACID COMPOUND AKR1C3, SLC5A1, GPR119 POLL 4357/4885FFAR1 219/4885GABRA1 1462/4885
US-20240025918-A1 KRAS G12D Inhibitors KRAS, NRAS, HRAS POLL 1476/4885FFAR1 3596/4885GABRA1 3975/4885

“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.