SCHEMBL21902203

SCHEMBL21902203

C1=Cc2c(oc3cc(Nc4ccc5c(c4)oc4ccccc45)ccc23)CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 9/20 0.43
▸ SMN1; SMN2 Q16637 9/20 0.43
▸ MEN1 O00255 8/20 0.43
▸ NPC1 O15118 8/20 0.43
▸ RAB9A P51151 8/20 0.43
▸ LMNA P02545 5/20 0.43
▸ HTT P42858 4/20 0.43
▸ GAA P10253 3/20 0.43
▸ MAPT P10636 6/20 0.42
▸ KDM4E B2RXH2 5/20 0.42
▸ HPGD P15428 5/20 0.42
▸ HSD17B10 Q99714 4/20 0.42
▸ TP53 P04637 3/20 0.42
▸ ALDH1A1 P00352 8/20 0.41
▸ TSHR P16473 2/20 0.41
▸ POLB P06746 1/20 0.41
▸ NPSR1 Q6W5P4 2/20 0.40
▸ MAPK1 P28482 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39

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
SCHEMBL22538374 0.91 ALDH1A1 (0.46) KMT2ASMN1; SMN2MEN1NPC1RAB9A
SCHEMBL24027751 0.87 DUSP3 (0.42) KMT2ASMN1; SMN2MEN1NPC1RAB9A
SCHEMBL22591438 0.84 MEN1 (0.36) KMT2ASMN1; SMN2MEN1NPC1RAB9A
SCHEMBL12241283 0.83 SIGMAR1 (0.38) KMT2ASMN1; SMN2MEN1NPC1RAB9A
SCHEMBL12174099 0.82 AHR (0.44) KMT2ASMN1; SMN2MEN1NPC1RAB9A
SCHEMBL17723282 0.80 EPHX2 (0.37) KMT2AMEN1LMNAMAPTKDM4E
SCHEMBL17283499 0.80 KMT2A (0.60) KMT2ASMN1; SMN2MEN1NPC1RAB9A
Formaldehyde SCHEMBL27552693 0.78 KDM4E (0.38) KMT2ASMN1; SMN2MEN1NPC1RAB9A
SCHEMBL21707325 0.78 AHR (0.35) KMT2ASMN1; SMN2MEN1NPC1RAB9A
SCHEMBL14052191 0.76 MAOA (0.39) KMT2ASMN1; SMN2MEN1NPC1RAB9A

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
US-11502257-B2 Organic electroluminescence device and amine compound for organic electroluminescence device SAMSUNG DISPLAY CO., LTD. (KR) 2022-11-15 — — US disclosed
US-20200127208-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND AMINE COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2020-04-23 — — US disclosed
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