SCHEMBL2722982

SCHEMBL2722982

C=CC(=O)Nc1ccc(C(C)Br)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 12/20 0.61
F13A1 P00488 2/20 0.61
TGM1 P22735 2/20 0.61
LMNA P02545 1/20 0.61
TGM3 Q08188 1/20 0.61
THRA P10827 1/20 0.51
THRB P10828 1/20 0.51
FYN P06241 1/20 0.45
SRC P12931 1/20 0.45
EGFR P00533 1/20 0.44
CYP2C19 P33261 1/20 0.44
CDK7 P50613 1/20 0.43
CDK13 Q14004 1/20 0.43
NPC1 O15118 1/20 0.41
TSHR P16473 1/20 0.41
NFKB1 P19838 1/20 0.41
RAB9A P51151 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL38661653 1.00 TGM2 (0.61) TGM2F13A1TGM1LMNATGM3
SCHEMBL1381808 0.86 TGM2 (0.65) TGM2F13A1TGM1LMNATGM3
SCHEMBL23328326 0.83 TGM2 (0.61) TGM2F13A1TGM1LMNATGM3
SCHEMBL2723385 0.83 TGM2 (0.61) TGM2F13A1TGM1LMNATGM3
SCHEMBL439369 0.81 TGM2 (0.79) TGM2F13A1TGM1LMNATGM3
SCHEMBL38661397 0.81 TGM2 (0.60) TGM2F13A1TGM1LMNATGM3
SCHEMBL38664259 0.81 TGM2 (0.60) TGM2F13A1TGM1LMNATGM3
SCHEMBL10033524 0.80 TSHR (0.60) TGM2F13A1TGM1LMNATGM3
SCHEMBL2724911 0.79 TGM2 (0.56) TGM2F13A1TGM1LMNATGM3
SCHEMBL21787312 0.79 TGM2 (0.65) TGM2F13A1TGM1LMNATGM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4612392-A N-substituted acrylamide and methacrylamide derivatives and their preparation BASF AKTIENGESELLSCHAFT (DE) 1986-09-16 US claimed
US-10023782-B2 Salt-tolerant, thermally-stable rheology modifiers ISP INVESTMENTS LLC (US) 2018-07-17 US disclosed
US-20170335162-A1 SALT-TOLERANT, THERMALLY-STABLE RHEOLOGY MODIFIERS HERCULES LLC 2017-11-23 US disclosed
US-9611416-B2 Salt-tolerant, thermally-stable rheology modifiers ISP INVESTMENTS LLC (US) 2017-04-04 US disclosed
US-20130324443-A1 SALT-TOLERANT, THERMALLY-STABLE RHEOLOGY MODIFIERS ISP INVESTMENTS INC. (US) 2013-12-05 US disclosed
WO-2013162902-A1 SYNERGISTIC COMBINATION OF A FLUID LOSS ADDITIVE AND RHEOLOGY MODIFIER ISP INVESTMENTS INC (US) 2013-10-31 WO disclosed
WO-2013138156-A1 SYNTHESIS AND APPLICATION OF HIGH PRESSURE HIGH TEMPERATURE FLUID LOSS ADDITIVE AND RHEOLOGY STABILIZER ISP INVESTMENTS INC. (US) 2013-09-19 WO disclosed
WO-2012061147-A1 SALT-TOLERANT, THERMALLY-STABLE RHEOLOGY MODIFIERS ISP INVESTMENTS INC. (US) 2012-05-10 WO disclosed
US-4612392-A N-substituted acrylamide and methacrylamide derivatives and their preparation BASF AKTIENGESELLSCHAFT (DE) 1986-09-16 US disclosed
EP-0087714-B1 N-SUBSTITUTED (METH)-ACRYL AMIDE DERIVATIVES AND THEIR PREPARATION BASF Aktiengesellschaft (DE) 1984-12-05 EP disclosed
EP-0087714-A1 N-Substituted (meth)-acryl amide derivatives and their preparation BASF Aktiengesellschaft (DE) 1983-09-07 EP disclosed