SCHEMBL9008987

SCHEMBL9008987

Oc1cc(F)cc(-c2ccccn2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KAT6A Q92794 3/20 0.50
GRM5 P41594 8/20 0.49
KAT7 O95251 1/20 0.48
DRD2 P14416 1/20 0.48
METAP2 P50579 1/20 0.48
KAT6B Q8WYB5 1/20 0.48
KAT5 Q92993 1/20 0.48
KDM1A O60341 1/20 0.48
KDM4E B2RXH2 1/20 0.45
LMNA P02545 1/20 0.45
CYP1A2 P05177 1/20 0.45
POLB P06746 1/20 0.45
CCR1 P32246 1/20 0.45
CCR5 P51681 1/20 0.45
CCR8 P51685 1/20 0.45
METAP1 P53582 1/20 0.45
BLM P54132 1/20 0.45
HIF1A Q16665 1/20 0.45
DOHH Q9BU89 1/20 0.45
P4HTM Q9NXG6 1/20 0.45

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
SCHEMBL5945969 0.87 GRM5 (0.56) KAT6AGRM5KAT7DRD2METAP2
SCHEMBL5846133 0.87 GRM5 (0.60) KAT6AGRM5KAT7DRD2METAP2
SCHEMBL6067871 0.87 KDM4E (0.54) KDM4ELMNACYP1A2POLBCCR1
Hydrochloric Acid SCHEMBL6068087 0.85 KDM4E (0.52) KDM4ELMNACYP1A2POLBCCR1
SCHEMBL21390791 0.80 EGFR (0.49) KAT6AKDM4ELMNACYP1A2POLB
SCHEMBL23525598 0.79 PKMYT1 (0.52) KAT6AGRM5KDM4ELMNACYP1A2
SCHEMBL22779452 0.79 GRM5 (0.49) KAT6AGRM5KDM4ELMNACYP1A2
SCHEMBL30610279 0.79 PKMYT1 (0.52) KAT6AGRM5KDM4ELMNACYP1A2
SCHEMBL27433221 0.78 ABL1 (0.50) KDM4ELMNACYP1A2POLBCCR1
SCHEMBL18311301 0.77 KAT6A (0.62) KAT6AGRM5KAT7DRD2METAP2

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-5576338-A ANTIALLERGENS, ANTIHISTAMINES, ANTIINFLAMMATORY AGENTS AND CYTOPROTECTIVE AGENTS FOR CARDIOVASCULAR DISORDERS MERCK FROSST CANADA, INC. (CA) 1996-11-19 US disclosed