SCHEMBL28646265

SCHEMBL28646265

Cc1cc2c(cc1Br)Cc1c(N)cccc1-2

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PGR P06401 2/20 0.33
CD44 P16070 1/20 0.32
PNMT P11086 1/20 0.32
TYR P14679 1/20 0.32
CYP3A4 P08684 1/20 0.31
TSHR P16473 1/20 0.31
PIK3CA P42336 1/20 0.31
PARP1 P09874 1/20 0.31
KDM4E B2RXH2 1/20 0.31
NPC1 O15118 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ACHE P22303 1/20 0.31
BRD4 O60885 1/20 0.31
HSP90AA1 P07900 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
SCHEMBL546799 0.75 BCHE (0.39) PGRNPC1MAPTRAB9A
SCHEMBL27857062 0.71 RAB9A (0.61) PNMTCYP3A4TSHRPARP1KDM4E
SCHEMBL20364104 0.71 ALDH1A1 (0.48) CD44PNMTTYRCYP3A4TSHR
SCHEMBL30497776 0.70 PNMT (0.58) CD44PNMTPARP1KDM4ENPC1
SCHEMBL221400 0.70 PNMT (0.58) CD44PNMTPARP1KDM4ENPC1
SCHEMBL20579979 0.70 CD44 (0.33) CD44TYRCYP3A4TSHRPIK3CA
Bromide SCHEMBL28349432 0.69 PNMT (0.56) CD44PNMTPARP1KDM4ENPC1
Benzene SCHEMBL28031985 0.69 PNMT (0.56) CD44PNMTPARP1KDM4ENPC1
Hydrochloric Acid SCHEMBL2866030 0.69 PNMT (0.56) CD44PNMTTSHRPARP1KDM4E
SCHEMBL21132350 0.68 PGR (0.49) PGRPNMTNPC1MAPTRAB9A

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
CN-117659762-A High-sensitivity heat-and-humidity-resistant thermosensitive microcapsule dispersion liquid, preparation method and thermosensitive film 南阳柯丽尔科技有限公司 2024-03-08 CN disclosed
CN-113508039-A Thermosensitive recording medium and image forming method 佳能株式会社 2021-10-15 CN disclosed