SCHEMBL25866818

SCHEMBL25866818

CCCCCCCCc1ccc(N(c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3C)c(C)c2)c2ccc(-c3ccc(N(c4ccccc4)c4ccc5c(c4)C(C)(C)c4ccccc4-5)cc3C)c(C)c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 2/20 0.41
▸ GPR3 P46089 1/20 0.39
▸ KCNH2 Q12809 1/20 0.37
▸ STAT3 P40763 1/20 0.37
▸ HTR2A P28223 1/20 0.36
▸ HSD11B1 P28845 2/20 0.35
▸ LPL P06858 5/20 0.34
▸ LIPG Q9Y5X9 5/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ TRPV1 Q8NER1 1/20 0.34
▸ MGLL Q99685 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ ESR1 P03372 1/20 0.33
▸ SHBG P04278 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ ADRA2A P08913 1/20 0.33
▸ ADORA3 P0DMS8 1/20 0.33
▸ HSPD1 P10809 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
SCHEMBL25866855 0.88 GPR3 (0.39) RARBGPR3KCNH2STAT3HTR2A
SCHEMBL19075301 0.87 GPR3 (0.45) GPR3KCNH2STAT3HTR2ALPL
SCHEMBL11887112 0.87 PDK2 (0.39) GPR3KCNH2HTR2AHSD11B1ALDH1A1
SCHEMBL25866833 0.87 HSD11B1 (0.39) RARBGPR3KCNH2STAT3HSD11B1
SCHEMBL25866814 0.87 RARB (0.39) RARBGPR3KCNH2STAT3HTR2A
SCHEMBL25866841 0.86 HSD11B1 (0.39) RARBGPR3STAT3HSD11B1ALDH1A1
SCHEMBL13597530 0.86 ALDH1A1 (0.40) GPR3KCNH2STAT3HSD11B1ALDH1A1
SCHEMBL26226736 0.84 GPR3 (0.39) RARBGPR3KCNH2STAT3HSD11B1
SCHEMBL15866065 0.84 PDK2 (0.39) KCNH2HTR2AALDH1A1KDM4EESR1
SCHEMBL15866067 0.84 PDK2 (0.39) KCNH2HTR2AALDH1A1KDM4EESR1

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-11702542-B2 Composition including polymer, interlayer prepared from the composition, and device comprising the same SAMSUNG DISPLAY CO., LTD. (KR) 2023-07-18 — — US disclosed
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