SCHEMBL31443274

SCHEMBL31443274

CCOc1ccccc1-c1ccc2c(c1)Oc1cc(Br)ccc1N2C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPRC P08575 1/20 0.45
▸ NPC1 O15118 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ PDE3A Q14432 1/20 0.43
▸ HTR2C P28335 2/20 0.41
▸ DHFR P00374 1/20 0.40
▸ HTR2A P28223 1/20 0.39
▸ NR3C1 P04150 1/20 0.39
▸ GRM2 Q14416 1/20 0.37
▸ GRM5 P41594 1/20 0.37
▸ GRIA2 P42262 1/20 0.36
▸ GRIA4 P48058 1/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ TSHR P16473 3/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ PKM P14618 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ ENPP3 O14638 1/20 0.35
▸ ENPP1 P22413 1/20 0.35
▸ LMNA P02545 1/20 0.35

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
SCHEMBL31443277 0.80 NQO1 (0.37) NPC1SMN1; SMN2ALDH1A1KDM4EHPGD
SCHEMBL31314192 0.77 AHR (0.37) SMN1; SMN2ALDH1A1HPGDENPP3ENPP1
SCHEMBL31314477 0.76 AHR (0.44) NPC1SMN1; SMN2HTR2CHTR2AALDH1A1
SCHEMBL31314363 0.74 AHR (0.54) ALDH1A1KDM4ELMNAAHRKMT2A
SCHEMBL31314293 0.73 CYP2A6 (0.44) NPC1SMN1; SMN2ALDH1A1KDM4ETP53
SCHEMBL19417312 0.73 AHR (0.55) SMN1; SMN2ALDH1A1KDM4EHPGDLMNA
SCHEMBL31314329 0.73 GABRA1 (0.41) NPC1SMN1; SMN2GRM5ALDH1A1TSHR
SCHEMBL31443275 0.71 NQO1 (0.44) NPC1SMN1; SMN2ALDH1A1TSHRKDM4E
SCHEMBL31314172 0.70 GABRP (0.42) NPC1SMN1; SMN2ALDH1A1TP53AHR
SCHEMBL31314359 0.69 KDM4E (0.40) NPC1SMN1; SMN2ALDH1A1TSHRKDM4E

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
CN-119409658-A Phenoxazine derivatives for preparing anode materials of electrochromic devices, preparation method thereof, anode materials and electrochromic medium composition 宁波华瓴光学技术有限公司 2025-02-11 — — CN disclosed
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