SCHEMBL30451373

SCHEMBL30451373

Cc1nnc(N)c2ccccc12

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.71
SMN1; SMN2 Q16637 2/20 0.47
ALDH1A1 P00352 3/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
ESR1 P03372 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
HPGD P15428 2/20 0.42
HSD17B10 Q99714 2/20 0.42
CYP1A2 P05177 1/20 0.42
NUDT1 P36639 1/20 0.42
GPR3 P46089 1/20 0.41
POLB P06746 2/20 0.40
ENPP3 O14638 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
MAPK1 P28482 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL2578812 1.00 KDM4E (0.71) KDM4ESMN1; SMN2ALDH1A1NPC1RAB9A
Formic Acid SCHEMBL30451955 0.88 KDM4E (0.56) KDM4ESMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL221530 0.84 KDM4E (1.00) KDM4ESMN1; SMN2ALDH1A1RAB9AKMT2A
SCHEMBL31416835 0.84 KDM4E (1.00) KDM4ESMN1; SMN2ALDH1A1RAB9AKMT2A
SCHEMBL89446 0.84 SMN1; SMN2 (0.58) SMN1; SMN2ALDH1A1NPC1RAB9AESR1
Trifluoroacetic Acid SCHEMBL29015449 0.82 KDM4E (0.48) KDM4ESMN1; SMN2ALDH1A1ESR1MEN1
Ammonia Solution, Strong SCHEMBL27658861 0.82 SMN1; SMN2 (0.56) SMN1; SMN2ALDH1A1NPC1RAB9AESR1
Chlorobenzene SCHEMBL27858714 0.80 KDM4E (0.46) KDM4ESMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL20116540 0.76 KDM4E (0.39) KDM4ESMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL30502565 0.74 KDM4E (0.43) KDM4ECYP1A2POLBL3MBTL1

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
CN-118715231-A Complement factor inhibitors and uses thereof 安尼艾克松股份有限公司 2024-09-27 CN disclosed
CN-116947903-A Inhibitors of complement factors and uses thereof 安尼艾克松股份有限公司 2023-10-27 CN disclosed
CN-116261564-A Inhibitors of complement factors and uses thereof 安尼艾克松股份有限公司 2023-06-13 CN disclosed