SCHEMBL9008372

SCHEMBL9008372

O=CCOP(Oc1ccccn1)Oc1ccccn1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.33
NPC1 O15118 3/20 0.33
ALDH1A1 P00352 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
LMNA P02545 1/20 0.33
CYP1A2 P05177 1/20 0.33
POLB P06746 1/20 0.33
CCR1 P32246 1/20 0.33
CCR5 P51681 1/20 0.33
CCR8 P51685 1/20 0.33
METAP1 P53582 1/20 0.33
BLM P54132 1/20 0.33
HIF1A Q16665 1/20 0.33
DOHH Q9BU89 1/20 0.33
P4HTM Q9NXG6 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
TSHR P16473 1/20 0.32
RAB9A P51151 2/20 0.31
MEN1 O00255 1/20 0.31

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
SCHEMBL31124123 0.78 NPC1 (0.42) KDM4ENPC1ALDH1A1SMN1; SMN2LMNA
SCHEMBL938005 0.78 NPC1 (0.42) KDM4ENPC1ALDH1A1SMN1; SMN2LMNA
SCHEMBL7629364 0.78 KDM4E (0.48) KDM4ENPC1ALDH1A1SMN1; SMN2LMNA
SCHEMBL14016487 0.71 KDM4E (0.36) KDM4ENPC1ALDH1A1LMNACYP1A2
SCHEMBL14016608 0.69 KDM4E (0.38) KDM4ENPC1ALDH1A1CYP2D6CYP2C19
SCHEMBL5728923 0.67 HTR1A (0.39) KDM4ENPC1ALDH1A1SMN1; SMN2LMNA
SCHEMBL711331 0.66
SCHEMBL28458865 0.66 KDM4E (0.44) KDM4ENPC1ALDH1A1SMN1; SMN2LMNA
SCHEMBL13839490 0.66 RAB9A (0.39) KDM4ENPC1ALDH1A1SMN1; SMN2LMNA
Benzene SCHEMBL28297131 0.65 KDM4E (0.42) KDM4ENPC1ALDH1A1SMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5532334-A HEAT RESISTANCE KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1996-07-02 US disclosed
EP-0017422-B1 THERMOPLASTIC POLYAMIDEIMIDE COPOLYMERS AND METHOD OF PREPARATION TORAY INDUSTRIES, INC. (JP) 1983-11-30 EP disclosed
US-4299945-A HEAT POLYMERIZATION OF AN AROMATIC DIAMINO COMPOUND AND AN AROMATIC TRIBASIC CARBOXYLIC ACID TORAY INDUSTRIES, INC. (JP) 1981-11-10 US disclosed
EP-0017422-A1 Thermoplastic polyamideimide copolymers and method of preparation TORAY INDUSTRIES, INC. (JP) 1980-10-15 EP disclosed