SCHEMBL11607136

SCHEMBL11607136

CC(C)(C)c1cc(CBr)on1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
INSR P06213 1/20 0.36
IGF1R P08069 1/20 0.36
FGFR1 P11362 1/20 0.36
KDR P35968 1/20 0.36
CNR2 P34972 1/20 0.33
MAPK14 Q16539 4/20 0.33

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
SCHEMBL8388696 0.81 ALDH1A1 (0.40) ALDH1A1INSRIGF1RFGFR1KDR
SCHEMBL3765271 0.79 NOTUM (0.43) ALDH1A1INSRIGF1RFGFR1KDR
SCHEMBL15199527 0.79 ALDH1A1 (0.39) ALDH1A1INSRIGF1RFGFR1KDR
SCHEMBL411970 0.79 KDM4E (0.34) ALDH1A1
SCHEMBL2271449 0.79 NOTUM (0.43) ALDH1A1INSRIGF1RFGFR1KDR
SCHEMBL3765254 0.79 ALDH1A1 (0.39) ALDH1A1INSRIGF1RFGFR1KDR
SCHEMBL16939227 0.78 RAB9A (0.42) ALDH1A1
SCHEMBL15199525 0.76 ALDH1A1 (0.37) ALDH1A1INSRIGF1RFGFR1KDR
SCHEMBL21690697 0.76 ALDH1A1 (0.37) ALDH1A1INSRIGF1RFGFR1KDR
SCHEMBL21325315 0.76 ALDH1A1 (0.37) ALDH1A1INSRIGF1RFGFR1KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4124591-A HERBICIDES, PLANT GROWTH REGULATORS BASF AKTIENGESELLSCHAFT (DE) 1978-11-07 US disclosed