SCHEMBL27983232

SCHEMBL27983232

Brc1ccc(-c2ccc3c(c2-c2ccc(Br)cc2)Cc2ccccc2-3)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 2/20 0.40
PNMT P11086 1/20 0.40
ALDH1A1 P00352 2/20 0.36
MAPK1 P28482 1/20 0.36
ADORA2A P29274 1/20 0.36
ADORA1 P30542 1/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA4 P22748 2/20 0.35
CA6 P23280 2/20 0.35
MAP3K9 P80192 1/20 0.33
MAP3K11 Q16584 1/20 0.33
SLC6A3 Q01959 1/20 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
SCHEMBL30150694 0.86 ADORA2A (0.45) PGRPNMTALDH1A1ADORA2AADORA1
SCHEMBL29766669 0.86 ADORA2A (0.47) PGRPNMTALDH1A1ADORA2AADORA1
SCHEMBL150217 0.86 ADORA2A (0.47) PGRPNMTALDH1A1ADORA2AADORA1
SCHEMBL7520992 0.84 PNMT (0.47) PNMTALDH1A1MAPK1ADORA2AADORA1
Ammonia Solution, Strong SCHEMBL15283068 0.84 ADORA2A (0.46) PGRPNMTALDH1A1ADORA2AADORA1
SCHEMBL29409546 0.83 NPC1 (0.51) PGRPNMTALDH1A1ADORA2AADORA1
SCHEMBL29907851 0.83 CHEK1 (0.48) PGRPNMTALDH1A1ADORA2AADORA1
SCHEMBL1034458 0.83 NPC1 (0.51) PGRPNMTALDH1A1ADORA2AADORA1
SCHEMBL1289716 0.83 PGR (0.40) PGRPNMTALDH1A1ADORA2AADORA1
SCHEMBL1828388 0.83 CHEK1 (0.48) PGRPNMTALDH1A1ADORA2AADORA1

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-108883983-A Intermediate film for laminated glasses 株式会社可乐丽 2018-11-23 CN disclosed
CN-104449664-A Organic semiconductor material, preparation method thereof and electroluminescent device OCEANS KING LIGHTING SCIENCE 2015-03-25 CN disclosed