SCHEMBL5010087

SCHEMBL5010087

Clc1ccc(C(c2ccc(NCCCc3ccccc3)cc2)c2ccc(NCCCc3ccccc3)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 5/20 0.53
CNR2 P34972 3/20 0.53
ALDH1A1 P00352 3/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
MAPT P10636 3/20 0.52
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
LMNA P02545 1/20 0.52
HTT P42858 1/20 0.52
CHRM1 P11229 1/20 0.48
HTR2A P28223 1/20 0.48
MCHR1 Q99705 1/20 0.48
TP53 P04637 1/20 0.48
GAA P10253 1/20 0.48
THRB P10828 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
SIGMAR1 Q99720 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
PIK3CD O00329 2/20 0.44

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
SCHEMBL3905892 0.91 L3MBTL1 (0.52) CNR1CNR2ALDH1A1MAPTMEN1
Hydrochloric Acid SCHEMBL6419975 0.89 ALDH1A1 (0.59) CNR1CNR2ALDH1A1SMN1; SMN2MAPT
SCHEMBL5010082 0.81 NPC1 (0.51) CNR2ALDH1A1SMN1; SMN2MAPTMEN1
SCHEMBL3907319 0.80 L3MBTL1 (0.70) CNR1ALDH1A1SMN1; SMN2MAPTMEN1
SCHEMBL5011845 0.79 CNR2 (0.49) CNR1CNR2ALDH1A1SMN1; SMN2MAPT
SCHEMBL1334972 0.78 L3MBTL1 (0.72) ALDH1A1MAPTMEN1KMT2AL3MBTL1
SCHEMBL22894161 0.74 CHRM1 (0.56) CNR1ALDH1A1SMN1; SMN2MAPTMEN1
SCHEMBL1120535 0.74 SMN1; SMN2 (0.57) CNR1CNR2ALDH1A1SMN1; SMN2MAPT
SCHEMBL5543628 0.74 CHRM1 (0.52) CNR1ALDH1A1SMN1; SMN2MAPTMEN1
SCHEMBL15131051 0.74 SIGMAR1 (0.55) CNR1CNR2ALDH1A1SMN1; SMN2TP53

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-20080311524-A1 Method For Making Negative-Working Heat-Sensitive Lithographic Printing Plate Precursor AGFA GRAPHICS N.V. (BE) 2008-12-18 US disclosed
US-20060078802-A1 Holographic storage medium SABIC INNOVATIVE PLASTICS IP B.V. 2006-04-13 US disclosed
EP-0239868-B1 PHOTOCHROMIC SYSTEM, LAYER PREPARED THEREOF AND ITS USE BASF Aktiengesellschaft (DE) 1989-12-27 EP disclosed
US-4857438-A Photochromic system and layers produced therewith BASF AKTIENGESELLSCHAFT (DE) 1989-08-15 US disclosed
EP-0239868-A1 Photochromic system, layer prepared thereof and its use BASF Aktiengesellschaft (DE) 1987-10-07 EP disclosed
US-4332884-A USING A DIOXIME CHELATING AGENT RICOH CO., LTD. (JP) 1982-06-01 US disclosed
US-4306014-A AMMONIA OR AMINES SUPPRESS THE COLOR-FORMING REACTION SYSTEM RICOH CO., LTD. (JP) 1981-12-15 US disclosed
US-4251619-A Process for forming photo-polymeric image KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1981-02-17 US disclosed