SCHEMBL22652986

SCHEMBL22652986

c1ccc2c(c1)NC1c3ccccc3-c3ccccc3C21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.39
IDO1 P14902 1/20 0.37
ALDH1A1 P00352 4/20 0.36
HPGD P15428 4/20 0.36
TNKS2 Q9H2K2 3/20 0.36
KDM4E B2RXH2 3/20 0.36
HSD17B10 Q99714 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
TSHR P16473 1/20 0.36
PBRM1 Q86U86 1/20 0.36
NLRP3 Q96P20 1/20 0.35
GPR3 P46089 1/20 0.34
PDE6D O43924 5/20 0.34
GAA P10253 2/20 0.33
MAPT P10636 2/20 0.33
MEN1 O00255 1/20 0.33
ALOX15 P16050 1/20 0.33
MAPK1 P28482 1/20 0.33
KMT2A Q03164 1/20 0.33
MCL1 Q07820 1/20 0.33

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
SCHEMBL18905201 0.74 NLRP3 (0.42) IDO1ALDH1A1HPGDTNKS2KDM4E
SCHEMBL524603 0.71 GPR3 (0.50) HTR2AGPR3MEN1MAPK1KMT2A
SCHEMBL29950614 0.71 GPR3 (0.50) HTR2AGPR3MEN1MAPK1KMT2A
SCHEMBL14460914 0.71 NLRP3 (0.49) ALDH1A1HPGDTNKS2KDM4EHSD17B10
SCHEMBL22506947 0.70 MEN1 (0.38) IDO1ALDH1A1HPGDTNKS2KDM4E
SCHEMBL22131494 0.69 MEN1 (0.40) HTR2AALDH1A1HPGDTNKS2KDM4E
SCHEMBL9899341 0.67 IDO1 (0.45) IDO1ALDH1A1HPGDTNKS2KDM4E
SCHEMBL19032599 0.67 NLRP3 (0.38) IDO1ALDH1A1HPGDTNKS2KDM4E
SCHEMBL14614362 0.65 HTR2A (0.41) HTR2AIDO1ALDH1A1HPGDTNKS2
SCHEMBL20418095 0.65 HTR2A (0.46) HTR2AIDO1ALDH1A1HPGDTNKS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240074230-A1 MATERIALS FOR FORMING A NUCLEATION-INHIBITING COATING AND DEVICES INCORPORATING SAME OTI LUMIONICS INC. (CA) 2024-02-29 US disclosed
US-20240074230-A1 MATERIALS FOR FORMING A NUCLEATION-INHIBITING COATING AND DEVICES INCORPORATING SAME OTI LUMIONICS INC. (CA) 2024-02-29 US disclosed
US-11730012-B2 Materials for forming a nucleation-inhibiting coating and devices incorporating same OTI LUMIONICS INC. (CA) 2023-08-15 US disclosed
US-11730012-B2 Materials for forming a nucleation-inhibiting coating and devices incorporating same OTI LUMIONICS INC. (CA) 2023-08-15 US disclosed
WO-2023111919-A1 OPTO-ELECTRONIC DEVICE COMPRISING A PATTERNING COATING COMPRISING A PLURALITY OF MATERIALS OTI LUMIONICS INC. (CA) 2023-06-22 WO disclosed
US-20220221619-A1 MATERIALS FOR FORMING A NUCLEATION-INHIBITING COATING AND DEVICES INCORPORATING SAME OTI LUMIONICS INC. (CA) 2022-07-14 US disclosed
US-20220216414-A1 MATERIALS FOR FORMING A NUCLEATION-INHIBITING COATING AND DEVICES INCORPORATING SAME OTI LUMIONICS INC. (CA) 2022-07-07 US disclosed
WO-2020225778-A1 MATERIALS FOR FORMING A NUCLEATION-INHIBITING COATING AND DEVICES INCORPORATING SAME OTI LUMIONICS INC. (CA) 2020-11-12 WO disclosed