SCHEMBL2955488

SCHEMBL2955488

Cc1ccc(C)c(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)c1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.41
TDP1 Q9NUW8 2/20 0.34
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.32
SYK P43405 1/20 0.30
TP53 P04637 1/20 0.30
LMNA P02545 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2A6 P11509 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
SCHEMBL13475531 1.00 SMN1; SMN2 (0.41) SMN1; SMN2TDP1ALDH1A1GAASYK
SCHEMBL13475530 1.00 SMN1; SMN2 (0.41) SMN1; SMN2TDP1ALDH1A1GAASYK
SCHEMBL13475529 0.98 SMN1; SMN2 (0.42) SMN1; SMN2TDP1ALDH1A1SYKTP53
SCHEMBL14959916 0.92 SMN1; SMN2 (0.43) SMN1; SMN2TDP1ALDH1A1GAASYK
SCHEMBL13475912 0.84 SMN1; SMN2 (0.46) SMN1; SMN2TDP1ALDH1A1GAASYK
SCHEMBL10293003 0.81 LMNA (0.36) LMNA
SCHEMBL11995382 0.81 LMNA (0.36) LMNA
SCHEMBL2958390 0.79 PGK1 (0.34) LMNA
SCHEMBL15957609 0.76 SMN1; SMN2 (0.47) SMN1; SMN2TDP1ALDH1A1GAASYK
SCHEMBL9861984 0.76 SMN1; SMN2 (0.36) SMN1; SMN2TDP1ALDH1A1GAATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8298830-B2 Organic materials able to detect analytes MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2012-10-30 US disclosed
US-20100310424-A1 ORGANIC MATERIALS ABLE TO DETECT ANALYTES MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2010-12-09 US disclosed
US-7759127-B2 Organic materials able to detect analytes MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2010-07-20 US disclosed
US-7700366-B2 Fluorescent, semi-conductive polymers, and devices comprising them MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2010-04-20 US disclosed
US-20060073607-A1 Organic materials able to detect analytes MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2006-04-06 US disclosed
US-20050196775-A1 Fluorescent, semi-conductive polymers, and devices comprising them MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2005-09-08 US disclosed
WO-2005073338-A2 FLUORESCENT, SEMI-CONDUCTIVE POLYMERS, AND DEVICES COMPRISING THEM MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2005-08-11 WO disclosed