SCHEMBL9486305

SCHEMBL9486305

CCCCCC(CCCCC)N(C)C

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.43
LMNA P02545 1/20 0.40
DNM1 Q05193 5/20 0.39
TSHR P16473 1/20 0.39
THRB P10828 1/20 0.39
PLA2G1B P04054 1/20 0.38
PLA2G2A P14555 1/20 0.38
FDPS P14324 1/20 0.37

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
SCHEMBL6718103 0.97 TSHR (0.44) OPRM1LMNADNM1TSHRTHRB
SCHEMBL22096531 0.97 TSHR (0.44) OPRM1LMNADNM1TSHRTHRB
SCHEMBL20835164 0.97 TSHR (0.44) OPRM1LMNADNM1TSHRTHRB
SCHEMBL23437576 0.97 TSHR (0.44) OPRM1LMNADNM1TSHRTHRB
SCHEMBL22401146 0.97 TSHR (0.44) OPRM1LMNADNM1TSHRTHRB
SCHEMBL23437461 0.97 TSHR (0.44) OPRM1LMNADNM1TSHRTHRB
SCHEMBL22401186 0.97 TSHR (0.44) OPRM1LMNADNM1TSHRTHRB
SCHEMBL23437458 0.97 TSHR (0.44) OPRM1LMNADNM1TSHRTHRB
SCHEMBL20882132 0.97 TSHR (0.44) OPRM1LMNADNM1TSHRTHRB
SCHEMBL20219104 0.97 TSHR (0.44) OPRM1LMNADNM1TSHRTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10566539-B2 Organic semiconductor compounds and methods of use THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2020-02-18 US disclosed
US-20170186961-A1 ORGANIC SEMICONDUCTOR COMPOUNDS AND METHODS OF USE THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2017-06-29 US disclosed
EP-0322209-B1 COMPOUNDS SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1993-02-10 EP disclosed
US-4954339-A ANTICHOLESTEROL AGENTS, SEQUESTERING SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1990-09-04 US disclosed
CN-1034550-A Compound SMITH KLINE FRENCH LAB (GB) 1989-08-09 CN disclosed
WO-1989005828-A1 COMPOUNDS SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1989-06-29 WO disclosed
EP-0322209-A1 Compounds SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1989-06-28 EP disclosed
US-3976697-A Preparation of tertiary amines TEXACO INC. (US) 1976-08-24 US disclosed