SCHEMBL11670842

SCHEMBL11670842

CCN(c1ccccc1)C(C)OC(=O)Oc1cccc(-c2ccccc2)c1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ RXRA P19793 2/20 0.44
▸ RXRB P28702 2/20 0.44
▸ MTNR1A P48039 2/20 0.40
▸ MTNR1B P49286 2/20 0.40
▸ FFAR1 O14842 1/20 0.40
▸ FFAR4 Q5NUL3 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
SCHEMBL11702436 0.89 MAPT (0.44) —
SCHEMBL11671701 0.88 TDP1 (0.42) MTNR1AMTNR1B
SCHEMBL11671594 0.88 LMNA (0.44) —
SCHEMBL11672092 0.88 LMNA (0.45) MTNR1AMTNR1B
Hydrochloric Acid SCHEMBL11671225 0.87 TDP1 (0.41) MTNR1AMTNR1B
SCHEMBL11670757 0.87 GHSR (0.41) —
SCHEMBL11672792 0.85 MTNR1B (0.48) MTNR1AMTNR1BFFAR1
SCHEMBL11677133 0.84 MAOA (0.46) RXRARXRBFFAR1FFAR4
SCHEMBL11672045 0.84 PPARG (0.42) —
SCHEMBL11671871 0.83 MAPT (0.42) MTNR1AMTNR1B

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-4039526-A PRINTING, POLYACRYLONITRILE, POLYESTERS, POLYAMIDES BAYER AKTIENGESELLSCHAFT (DT) 1977-08-02 — — US disclosed
US-4039539-A 1,2,4-Triazole-azo-aniline cationic dyestuffs BAYER AKTIENGESELLSCHAFT (DT) 1977-08-02 — — US disclosed
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