SCHEMBL7759632

SCHEMBL7759632

CCc1cccc(CC)c1Nc1ccccc1C(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLCN2 P51788 6/20 1.00
FTO Q9C0B1 4/20 0.56
PTGS2 P35354 4/20 0.56
MEN1 O00255 3/20 0.55
AKR1C3 P42330 3/20 0.55
KMT2A Q03164 3/20 0.55
LMNA P02545 2/20 0.55
CYP1A2 P05177 2/20 0.55
CYP3A4 P08684 2/20 0.55
CYP2C9 P11712 2/20 0.55
HIF1A Q16665 2/20 0.55
AKR1B10 O60218 2/20 0.55
ABCB11 O95342 2/20 0.55
CHRM1 P11229 2/20 0.55
PTGS1 P23219 2/20 0.55
AKR1C2 P52895 2/20 0.55
AKR1C1 Q04828 2/20 0.55
TRPA1 O75762 1/20 0.55
DHFR P00374 1/20 0.55
MPO P05164 1/20 0.55

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
SCHEMBL7573477 0.87 CLCN2 (0.77) CLCN2FTOPTGS2MEN1AKR1C3
SCHEMBL27516871 0.86 CLCN2 (0.76) CLCN2PTGS2MEN1AKR1C3KMT2A
SCHEMBL20419707 0.86 CLCN2 (0.75) CLCN2FTOPTGS2MEN1AKR1C3
SCHEMBL22169241 0.83 CLCN2 (0.71) CLCN2FTOPTGS2MEN1AKR1C3
SCHEMBL7164856 0.80 PTGS2 (0.83) CLCN2PTGS2AKR1C3KMT2ALMNA
SCHEMBL10699208 0.80 CLCN2 (0.66) CLCN2PTGS2MEN1KMT2AAKR1B10
SCHEMBL7851667 0.79 PTGS2 (0.73) CLCN2FTOPTGS2MEN1AKR1C3
SCHEMBL24021567 0.79 CLCN2 (1.00) CLCN2FTOPTGS2MEN1AKR1C3
SCHEMBL8555568 0.78 PTGS2 (0.71) CLCN2FTOPTGS2MEN1AKR1C3
SCHEMBL355549 0.78 FABP4 (0.80) CLCN2PTGS2MEN1AKR1C3KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11173137-B2 Compositions and methods to modulate chloride ion channel activity THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2021-11-16 US disclosed
US-20010044511-A1 Polymerization of olefins E.I. DU PONT DE NEMOURS AND COMPANY 2001-11-22 US disclosed
WO-2001072854-A2 POLYMERIZATION OF OLEFINS E.I. DUPONT DE NEMOURS AND COMPANY (US) 2001-10-04 WO 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-11173137-B2 Compositions and methods to modulate chloride ion channel activity CLCN2, CLIC1, CLIC4 CLCN2 1/4885FTO 4582/4885PTGS2 2251/4885

“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.