SCHEMBL29985176

SCHEMBL29985176

CCCC(C(=O)O)c1c(C)nc2ccc(Cl)cc2c1-c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PSIP1 O75475 5/20 0.59
FABP3 P05413 3/20 0.59
FABP4 P15090 3/20 0.59
KDM4E B2RXH2 1/20 0.58
FABP5 Q01469 2/20 0.53
PLA2G2A P14555 1/20 0.52

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
SCHEMBL10325642 1.00 PSIP1 (0.59) PSIP1FABP3FABP4KDM4EFABP5
SCHEMBL12630063 0.88 PSIP1 (0.56) PSIP1FABP3FABP4KDM4EPLA2G2A
SCHEMBL12630048 0.82 FABP3 (0.56) PSIP1FABP3FABP4KDM4EFABP5
SCHEMBL27703986 0.80 FABP4 (0.65) FABP3FABP4KDM4EFABP5PLA2G2A
SCHEMBL12630062 0.80 PSIP1 (0.48) PSIP1FABP3FABP4KDM4EFABP5
SCHEMBL3321035 0.78 FABP4 (0.62) FABP3FABP4KDM4EFABP5PLA2G2A
SCHEMBL29985609 0.78 PSIP1 (0.52) PSIP1
SCHEMBL12630059 0.77 ALDH1A1 (0.46) PSIP1FABP3FABP4KDM4EFABP5
SCHEMBL12630061 0.76 KDM4E (0.42) PSIP1FABP3FABP4KDM4EFABP5
SCHEMBL27703988 0.75 FABP4 (0.58) FABP3FABP4KDM4EFABP5PLA2G2A

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-20220323494-A1 Novel Control Switch GLAXOSMITHKLINE IP DEV LTD (GB) 2022-10-13 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-20220323494-A1 Novel Control Switch TNFRSF9, TNFRSF1A, TNFSF11 PSIP1 1442/4885FABP3 2765/4885FABP4 3354/4885

“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.