SCHEMBL19774227

SCHEMBL19774227

COC(=O)c1cc(Br)c2ccccc2c1-c1cccc2c3c(oc12)CCC=C3

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.35
▸ HTT P42858 2/20 0.35
▸ ALDH1A1 P00352 3/20 0.33
▸ NR3C2 P08235 1/20 0.33
▸ ABCG2 Q9UNQ0 1/20 0.33
▸ SLC6A3 Q01959 1/20 0.33
▸ SIGMAR1 Q99720 2/20 0.33
▸ KDM4E B2RXH2 2/20 0.32
▸ HPGD P15428 2/20 0.32
▸ NPSR1 Q6W5P4 2/20 0.32
▸ PTPRC P08575 1/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ MAPK10 P53779 1/20 0.32
▸ PTK2B Q14289 1/20 0.32
▸ NCOA1 Q15788 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL19774396 0.88 PRMT1 (0.35) KMT2AHTTALDH1A1HPGDMEN1
SCHEMBL22005386 0.84 ALDH1A1 (0.39) KMT2AHTTALDH1A1SLC6A3KDM4E
SCHEMBL18566634 0.80 HDAC8 (0.47) KMT2AHTTALDH1A1ABCG2SLC6A3
SCHEMBL24896043 0.75 HTT (0.40) KMT2AHTTALDH1A1SLC6A3KDM4E
SCHEMBL13345820 0.73 KDM4E (0.50) KMT2AALDH1A1SLC6A3KDM4EHPGD
SCHEMBL10146692 0.72 — —
SCHEMBL24862845 0.71 HTT (0.40) KMT2AHTTALDH1A1ABCG2SLC6A3
SCHEMBL20733733 0.71 ALOX5 (0.30) —
SCHEMBL20363573 0.71 CYP2B6 (0.32) —
SCHEMBL20363794 0.71 PRKDC (0.34) ALDH1A1KDM4ETSHRSMN1; SMN2

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-4116297-A1 CONDENSED FLUORENE DERIVATIVE COMPRISING HETEROCYCLIC RING SFC Co., Ltd. (KR) 2023-01-11 — — EP disclosed
EP-3269790-A1 ORGANIC LIGHT-EMITTING DIODE WITH HIGH EFFICIENCY SFC Co., Ltd. (KR) 2018-01-17 — — EP disclosed
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