SCHEMBL24517643

SCHEMBL24517643

C=C(C)/C=C(\NC)c1ccccn1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.46
▸ TOP2A P11388 1/20 0.44
▸ KDM4E B2RXH2 5/20 0.43
▸ LMNA P02545 3/20 0.40
▸ CES2 O00748 1/20 0.40
▸ CES1 P23141 1/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ NAPRT Q6XQN6 1/20 0.39
▸ P4HTM Q9NXG6 1/20 0.39
▸ MAPK1 P28482 2/20 0.39
▸ RAB9A P51151 6/20 0.38
▸ SMN1; SMN2 Q16637 6/20 0.38
▸ HTT P42858 3/20 0.38
▸ TDP1 Q9NUW8 2/20 0.38
▸ PTBP1 P26599 1/20 0.38
▸ OPRK1 P41145 1/20 0.38
▸ MAPT P10636 4/20 0.37
▸ NPC1 O15118 3/20 0.37
▸ KMT2A Q03164 3/20 0.37
▸ TP53 P04637 2/20 0.37

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
SCHEMBL16751115 0.80 ALDH1A1 (0.48) ALDH1A1TOP2AKDM4ELMNACES2
SCHEMBL24766732 0.79 ALDH1A1 (0.52) ALDH1A1KDM4ELMNACES2CES1
SCHEMBL14818573 0.78 ALDH1A1 (0.47) ALDH1A1TOP2AKDM4ELMNACES2
SCHEMBL19450871 0.78 ALDH1A1 (0.43) ALDH1A1TOP2AKDM4ELMNACES2
SCHEMBL26218243 0.75 MAPK1 (0.38) ALDH1A1TOP2AKDM4ELMNACES2
SCHEMBL24412896 0.75 ALDH1A1 (0.47) ALDH1A1TOP2AKDM4ELMNACES2
SCHEMBL19123335 0.75 ALDH1A1 (0.43) ALDH1A1TOP2AKDM4ELMNACES2
SCHEMBL16429529 0.74 ALDH1A1 (0.50) ALDH1A1TOP2AKDM4ELMNACES2
SCHEMBL7748513 0.73 ALDH1A1 (0.42) ALDH1A1KDM4ELMNACES2CES1
SCHEMBL30736102 0.72 — —

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-20220190276-A1 LIGHT-EMITTING DEVICE AND AN ELECTRONIC APPARATUS INCLUDING SAME SAMSUNG DISPLAY CO., LTD. (KR) 2022-06-16 — — US disclosed
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