SCHEMBL10148342

SCHEMBL10148342

CCOC(=O)C1(C)Cc2cc(Br)ccc2CC1=O

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.38
GABRB1 P18505 1/20 0.38
GABRA3 P34903 1/20 0.38
GABRB2 P47870 1/20 0.38
TSHR P16473 1/20 0.37
HTT P42858 1/20 0.37
TDP2 O95551 2/20 0.37
BRD4 O60885 1/20 0.36
MAPT P10636 1/20 0.36
ALDH1A1 P00352 4/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
METAP1 P53582 1/20 0.35
APAF1 O14727 1/20 0.34
SMAD3 P84022 1/20 0.34
TP53 P04637 1/20 0.34
FGB P02675 1/20 0.34

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
SCHEMBL10148339 0.82 BRD4 (0.49) TSHRHTTBRD4MAPTALDH1A1
SCHEMBL10148344 0.81 METAP1 (0.41) TDP2BRD4MAPTMETAP1
SCHEMBL651424 0.80 MAPT (0.45) GABRA1GABRB1GABRA3GABRB2TSHR
SCHEMBL795467 0.78 ESR1 (0.40) GABRA1GABRB1GABRA3GABRB2TSHR
SCHEMBL31537527 0.78 ESR1 (0.40) GABRA1GABRB1GABRA3GABRB2TSHR
SCHEMBL30663973 0.76 TDP2 (0.40) TDP2BRD4MAPTALDH1A1SMN1; SMN2
SCHEMBL3310487 0.76 TDP2 (0.40) TDP2BRD4MAPTALDH1A1SMN1; SMN2
SCHEMBL3498263 0.73 ALDH1A1 (0.36) GABRA1GABRB1GABRA3GABRB2TSHR
SCHEMBL4769228 0.70 ALDH1A1 (0.39) TSHRHTTBRD4MAPTALDH1A1
SCHEMBL30975233 0.69 MAPT (0.47) GABRA1GABRB1GABRA3GABRB2TSHR

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-8119808-B2 Tetrahydroquinoline derivatives as cannabinoid receptor modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2012-02-21 US disclosed
US-20110104315-A1 TETRAHYDROQUINOLINE DERIVATIVES AS CANNABINOID RECEPTOR MODULATORS BRISTOL-MYERS SQUIBB COMPANY 2011-05-05 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-20110104315-A1 TETRAHYDROQUINOLINE DERIVATIVES AS CANNABINOID RECEPTOR MODULATORS CNR2, CNR1, OPRL1 GABRA1 236/4885GABRB1 263/4885GABRA3 184/4885

“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.