SCHEMBL19211520

SCHEMBL19211520

Cc1cccc(CN(C)C)c1C

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.55
ESR2 Q92731 1/20 0.55
TSHR P16473 2/20 0.49
SLC6A4 P31645 10/20 0.42
SLC6A2 P23975 8/20 0.42
SLC6A3 Q01959 6/20 0.42
HTR2A P28223 1/20 0.42
CYP2D6 P10635 2/20 0.40
ALDH1A1 P00352 2/20 0.40
LMNA P02545 2/20 0.40
NPY1R P25929 1/20 0.40
MAPK1 P28482 1/20 0.40
NPY2R P49146 1/20 0.40
TRPA1 O75762 1/20 0.39
ATM Q13315 1/20 0.39

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
SCHEMBL14468315 0.88 SLC6A4 (0.46) ESR1ESR2TSHRSLC6A4SLC6A2
SCHEMBL329228 0.81 SLC6A4 (0.48) TSHRSLC6A4SLC6A2SLC6A3HTR2A
SCHEMBL19918878 0.81 SLC6A4 (0.46) ESR1ESR2TSHRSLC6A4SLC6A2
SCHEMBL25644505 0.81 ESR1 (0.50) ESR1ESR2TSHRSLC6A4SLC6A2
SCHEMBL10619700 0.80 TSHR (0.47) ESR1ESR2TSHRSLC6A4SLC6A2
SCHEMBL27301457 0.79 SLC6A4 (0.47) TSHRSLC6A4SLC6A2SLC6A3HTR2A
SCHEMBL23341422 0.78 TAAR1 (0.47) TSHRSLC6A4SLC6A2SLC6A3HTR2A
SCHEMBL8045011 0.78 ALDH1A1 (0.52) ESR1ESR2TSHRHTR2AALDH1A1
SCHEMBL8045012 0.78 HTR2A (0.50) ESR1ESR2TSHRSLC6A4SLC6A2
SCHEMBL11621211 0.78 CD44 (0.46) TSHRSLC6A4SLC6A2SLC6A3HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3414277-A1 LEVELER COMPOSITIONS FOR USE IN COPPER DEPOSITION IN MANUFACTURE OF MICROELECTRONICS MacDermid Enthone Inc. (US) 2018-12-19 EP claimed
WO-2017139087-A1 LEVELER COMPOSITIONS FOR USE IN COPPER DEPOSITION IN MANUFACTURE OF MICROELECTRONICS MACDERMID ENTHONE INC. (US) 2017-08-17 WO claimed