SCHEMBL31074875

SCHEMBL31074875

Clc1ccnc(-c2cccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)c2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.48
KMO O15229 1/20 0.46
CYP19A1 P11511 1/20 0.46
ABCG2 Q9UNQ0 2/20 0.44
MAPT P10636 4/20 0.43
NPC1 O15118 1/20 0.43
MITF O75030 1/20 0.43
TP53 P04637 1/20 0.43
PKM P14618 1/20 0.43
TSHR P16473 1/20 0.43
GRM5 P41594 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MEN1 O00255 3/20 0.43
ALDH1A1 P00352 3/20 0.43
HPGD P15428 3/20 0.43
KMT2A Q03164 3/20 0.43
KDM4E B2RXH2 2/20 0.43
LMNA P02545 2/20 0.43
GLA P06280 1/20 0.43

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
SCHEMBL31074836 0.88 CCR1 (0.46) PIM1KMOABCG2MAPTNPC1
SCHEMBL18212389 0.86 MEN1 (0.47) PIM1KMOMAPTNPC1RAB9A
SCHEMBL3849043 0.86 PIM1 (0.53) PIM1KMOMAPTNPC1MITF
SCHEMBL38666098 0.83 PIM1 (0.40) PIM1KMOCYP19A1MAPTNPC1
SCHEMBL18327593 0.83 KMO (0.46) PIM1KMOMAPTMEN1ALDH1A1
SCHEMBL1662224 0.82 ASIC3 (0.59) PIM1KMONPC1SMN1; SMN2MEN1
SCHEMBL30986825 0.81 NR1I3 (0.55) CYP19A1ABCG2NPC1TP53TSHR
SCHEMBL15947898 0.81 PIM1 (0.57) PIM1KMOCYP19A1MAPTNPC1
SCHEMBL24722217 0.81 KMO (0.43) PIM1KMOCYP19A1MAPTMEN1
SCHEMBL21982352 0.81 CYP2A6 (0.53) KMOMAPTGRM5RAB9AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122070349-A Organic light-emitting compound and organic electroluminescent device comprising the same 索路思高新材料有限公司 2026-05-19 CN disclosed
WO-2024144208-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME 솔루스첨단소재 주식회사 2024-07-04 WO disclosed