SCHEMBL29354558

SCHEMBL29354558

c1ccc(Cn2c3ccc(N(c4ccccc4)c4ccccc4)cc3c3cc(N(c4ccccc4)c4ccccc4)ccc32)cc1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.55
SRC P12931 3/20 0.51
P2RX4 Q99571 1/20 0.49
SMN1; SMN2 Q16637 3/20 0.42
KMT2A Q03164 3/20 0.42
KDM4E B2RXH2 3/20 0.42
MEN1 O00255 2/20 0.42
MAPT P10636 2/20 0.42
MAPK1 P28482 2/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 3/20 0.41
PKM P14618 2/20 0.39
GAA P10253 1/20 0.39
NTRK1 P04629 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PGR P06401 1/20 0.38

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
SCHEMBL17449597 1.00 CYP19A1 (0.55) CYP19A1SRCP2RX4SMN1; SMN2KMT2A
SCHEMBL22063794 0.95 CYP19A1 (0.64) CYP19A1SRCP2RX4SMN1; SMN2KMT2A
SCHEMBL18135002 0.95 CYP19A1 (0.64) CYP19A1SRCP2RX4SMN1; SMN2KMT2A
SCHEMBL17965655 0.95 CYP19A1 (0.64) CYP19A1SRCP2RX4SMN1; SMN2KMT2A
SCHEMBL17965656 0.94 CYP19A1 (0.66) CYP19A1SRCP2RX4SMN1; SMN2KMT2A
SCHEMBL17414871 0.87 P2RX4 (0.53) P2RX4KMT2AMAPTMAPK1ALDH1A1
SCHEMBL12928019 0.86 CYP19A1 (0.51) CYP19A1P2RX4SMN1; SMN2KMT2AMEN1
SCHEMBL12928016 0.86 CYP19A1 (0.51) CYP19A1P2RX4SMN1; SMN2KMT2AMEN1
SCHEMBL14255202 0.84 CYP1A2 (0.47) KMT2AKDM4EMEN1MAPTMAPK1
SCHEMBL17954553 0.84 CYP19A1 (0.39) CYP19A1SRCP2RX4SMN1; SMN2KMT2A

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
EP-4372057-A2 TADF MATERIALS COMPRISING 4-(3-(2-(10H-PHENOXAZIN-10-YL)PYRIDIN-5-YL)-9H-CARBAZOL-9-YL)BENZONITRILE DERIVATIVES AND RELATED COMPOUNDS FOR USE IN OLEDS Noctiluca S.A. (PL) 2024-05-22 EP disclosed
EP-3943492-B1 TADF MATERIALS COMPRISING 4-(3-(2-(10H-PHENOXAZIN-10-YL)PYRIDIN-5-YL)-9H-CARBAZOL-9-YL)BENZONITRILE DERIVATIVES AND RELATED COMPOUNDS FOR USE IN OLEDS NOCTILUCA S A (PL) 2024-05-08 EP disclosed
EP-3943492-A1 TADF MATERIALS COMPRISING 4-(3-(2-(10H-PHENOXAZIN-10-YL)PYRIDIN-5-YL)-9H-CARBAZOL-9-YL)BENZONITRILE DERIVATIVES AND RELATED COMPOUNDS FOR USE IN OLEDS Noctiluca S.A. (PL) 2022-01-26 EP disclosed