SCHEMBL3935997

SCHEMBL3935997

CCCCCCc1cc(C=O)sc1-c1sc(-c2ccc(N(CC)CC)cc2)cc1CCCCCC

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.38
▸ ALDH3A1 P30838 1/20 0.38
▸ ALDH1A3 P47895 1/20 0.38
▸ MAPT P10636 1/20 0.34
▸ CNR2 P34972 10/20 0.33
▸ APP P05067 1/20 0.33
▸ INSR P06213 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ LTB4R Q15722 3/20 0.31
▸ HIF1A Q16665 1/20 0.30
▸ EPAS1 Q99814 1/20 0.30

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
SCHEMBL15859165 0.83 INSR (0.35) ALDH1A1ALDH3A1ALDH1A3MAPTCNR2
SCHEMBL3932935 0.83 CNR2 (0.34) MAPTCNR2INSRLTB4R
SCHEMBL12180551 0.82 APP (0.52) ALDH1A1MAPTAPPLTB4R
SCHEMBL20625203 0.78 HIF1A (0.35) ALDH1A1MAPTHIF1AEPAS1
SCHEMBL21243809 0.78 HIF1A (0.35) MAPTLTB4RHIF1AEPAS1
SCHEMBL31030240 0.78 APP (0.45) APP
SCHEMBL31030239 0.78 APP (0.45) APP
SCHEMBL19615830 0.74 DPP4 (0.40) ALDH1A1MAPTL3MBTL1HIF1AEPAS1
SCHEMBL19614811 0.74 GPR35 (0.32) MAPTHIF1AEPAS1
SCHEMBL28044579 0.73 GPR35 (0.34) MAPTHIF1AEPAS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7507840-B2 Acceptor compounds useful for making hyperpolarizable organic chromophores UNIVERSITY OF WASHINGTON (US) 2009-03-24 — — US disclosed
US-7029606-B2 Hyperpolarizable organic chromophores UNIVERSITY OF WASHINGTON (US) 2006-04-18 — — US disclosed
US-20050179013-A1 Hyperpolarizable organic chromophores UNIVERSITY OF WASHINGTON 2005-08-18 — — US disclosed
EP-1305305-A4 HYPERPOLARIZABLE ORGANIC CHROMOPHORES UNIV WASHINGTON (US) 2005-07-20 — — EP disclosed
EP-1305305-A1 HYPERPOLARIZABLE ORGANIC CHROMOPHORES The University of Washington (US) 2003-05-02 — — EP disclosed
US-6555027-B2 For use in electro-optic modulators, signal processing and telecommunications PACIFIC WAVE INDUSTRIES, INC. 2003-04-29 — — US disclosed
US-20020084446-A1 Hyperpolarizable organic chromophores UNITED STATES AIR FORCE 2002-07-04 — — US disclosed
US-6361717-B1 RING-LOCKED STRUCTURE; HEAT RESISTANT AND OPTICALLY TRANSPARENT AT TELECOMMUNICATION WAVELENGTHS; USED IN SIGNAL DETECTION/PROCESSING AND TELECOMMUNICATIONS PACIFIC WAVE INDUSTRIES, INC. 2002-03-26 — — US disclosed
US-20020027220-A1 Second-order nonlinear optical chromophores containing dioxine and/or bithiophene as conjugate bridge and devices incorporating the same MACOM TECHNOLOGY SOLUTIONS HOLDINGS, INC. 2002-03-07 — — US disclosed
WO-2002008215-A1 HYPERPOLARIZABLE ORGANIC CHROMOPHORES UNIVERSITY OF WASHINGTON (US) 2002-01-31 — — WO disclosed
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