SCHEMBL9682795

SCHEMBL9682795

COC(=O)/C=C/c1c2ccccc2nc2ccccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.54
KDM4E B2RXH2 3/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
PDE4B Q07343 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
IP6K1 Q92551 1/20 0.46
IP6K3 Q96PC2 1/20 0.46
IP6K2 Q9UHH9 1/20 0.46
POLB P06746 2/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
TYR P14679 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
MEN1 O00255 3/20 0.43
GLA P06280 1/20 0.43
ERN1 O75460 1/20 0.43
CYP1A2 P05177 1/20 0.43

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
SCHEMBL9682211 1.00 KMT2A (0.54) KMT2AKDM4ESMN1; SMN2PDE4BL3MBTL1
SCHEMBL23690433 0.86 L3MBTL1 (0.55) KMT2AKDM4ESMN1; SMN2PDE4BL3MBTL1
SCHEMBL18670699 0.82 CYP2D6 (0.52) KMT2AKDM4ESMN1; SMN2L3MBTL1POLB
SCHEMBL3704563 0.81 KDM4E (0.54) KMT2AKDM4ESMN1; SMN2CA1CA2
SCHEMBL2818992 0.81 KDM4E (0.54) KMT2AKDM4ESMN1; SMN2CA1CA2
SCHEMBL29236452 0.81 TOP2A (0.51) KMT2AKDM4ESMN1; SMN2POLBMEN1
SCHEMBL9682217 0.80 AKR1B10 (0.46) KMT2AKDM4EPOLBMEN1GLA
SCHEMBL11987691 0.80 L3MBTL1 (0.57) KMT2AKDM4ESMN1; SMN2PDE4BL3MBTL1
SCHEMBL9682234 0.80 ALDH1A1 (0.42) KMT2AKDM4ESMN1; SMN2POLBMEN1
SCHEMBL9682243 0.80 ALDH1A1 (0.42) KMT2AKDM4ESMN1; SMN2POLBMEN1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117986188-A Preparation method of 9-alkenyl substituted acridine derivative 郑州原理生物科技有限公司 2024-05-07 CN disclosed
US-5089377-A Acridin-9-yl acrylates ASAHI DENKA KOGYO K.K. (JP) 1992-02-18 US disclosed
US-4985564-A Acridine compound and photopolymerizable composition using the same HITACHI CHEMICAL CO., LTD. (JP) 1991-01-15 US disclosed