SCHEMBL30713642

SCHEMBL30713642

c1ccc2c(c1)CCc1cc3cccnc3cc1-2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.42
KDM4E B2RXH2 3/20 0.42
RAB9A P51151 2/20 0.42
MEN1 O00255 2/20 0.42
TP53 P04637 2/20 0.42
MAPT P10636 2/20 0.42
TSHR P16473 2/20 0.42
CYP2C19 P33261 2/20 0.42
KMT2A Q03164 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
HSD17B10 Q99714 2/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
PKM P14618 1/20 0.42
MAPK1 P28482 1/20 0.42
ALDH1A1 P00352 6/20 0.42
POLB P06746 2/20 0.42
PDGFRB P09619 1/20 0.41
PDGFRA P16234 1/20 0.41

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
SCHEMBL30713666 0.82 SRD5A1 (0.43) NPC1KDM4ERAB9AALDH1A1POLB
SCHEMBL30171471 0.80 NPC1 (0.50) NPC1KDM4ERAB9AMEN1TP53
SCHEMBL3417362 0.78 SRD5A1 (0.48) NPC1KDM4ERAB9AMEN1TP53
Fluorene SCHEMBL29030864 0.77 NPC1 (0.50) NPC1KDM4ERAB9AMEN1TP53
SCHEMBL20062355 0.76 ALDH1A1 (0.54) NPC1KDM4ERAB9AMEN1TP53
SCHEMBL4818156 0.73 CES1 (0.56) NPC1KDM4ERAB9AMAPTTSHR
SCHEMBL11977443 0.73 NPC1 (0.48) NPC1KDM4ERAB9AMEN1TP53
SCHEMBL21475276 0.73 NPC1 (0.48) NPC1KDM4ERAB9AMEN1TP53
SCHEMBL22824619 0.72 KDM4E (0.47) NPC1KDM4ERAB9AMEN1TP53
Fluorene SCHEMBL22207645 0.72 ALDH1A1 (0.65) NPC1KDM4ERAB9AMEN1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4680677-A1 BENZOTHIENOPYRROLE CYANINE DYES Beckman Coulter, Inc. (US) 2026-01-21 EP disclosed
EP-4547759-A2 NOVEL FLUORESCENT DYES AND POLYMERS FROM DIHYDROPHENANTHRENE DERIVATIVES Beckman Coulter, Inc. (US) 2025-05-07 EP disclosed
WO-2025064842-A1 DIHYDROPHENANTHRENE (DHP) BRIDGED DYES FOR USE IN FLOW CYTOMETRY BECKMAN COULTER, INC. (US) 2025-03-27 WO disclosed
CN-119630747-A Novel fluorescent dyes and polymers from dihydrophenanthrene derivatives 贝克曼库尔特有限公司 2025-03-14 CN disclosed
WO-2024196805-A1 BENZOTHIENOPYRROLE CYANINE DYES BECKMAN COULTER, INC. (US) 2024-09-26 WO disclosed
WO-2024044327-A1 DHNT MONOMERS AND POLYMER DYES WITH MODIFIED PHOTOPHYSICAL PROPERTIES BECKMAN COULTER, INC. (US) 2024-02-29 WO disclosed
WO-2024007016-A2 NOVEL FLUORESCENT DYES AND POLYMERS FROM DIHYDROPHENANTHRENE DERIVATIVES BECKMAN COULTER, INC. (US) 2024-01-04 WO disclosed