SCHEMBL30089239

SCHEMBL30089239

Cc1ccc2c(c1)c(C(=O)Nc1ccccc1C(=O)O)cn2Cc1ccccn1

nearest known ligand 0.78

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 1/20 0.78
KDM4E B2RXH2 2/20 0.48
ATM Q13315 1/20 0.42
CHRM1 P11229 1/20 0.42
LMNA P02545 2/20 0.42
THRB P10828 1/20 0.42
POLB P06746 2/20 0.41
MAPT P10636 2/20 0.41
KDR P35968 1/20 0.40
HPGD P15428 2/20 0.40
RAB9A P51151 2/20 0.40
ALDH1A1 P00352 1/20 0.40
NPC1 O15118 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
GAA P10253 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
SCHEMBL28584191 1.00 SLC22A12 (0.78) SLC22A12KDM4EATMCHRM1LMNA
SCHEMBL28573470 0.92 SLC22A12 (0.78) SLC22A12KDM4EATMCHRM1LMNA
SCHEMBL28589443 0.89 SLC22A12 (0.78) SLC22A12KDM4EPOLBALDH1A1SMN1; SMN2
SCHEMBL28573025 0.89 SLC22A12 (0.78) SLC22A12KDM4ECHRM1LMNATHRB
SCHEMBL28914750 0.89 SLC22A12 (0.78) SLC22A12KDM4ECHRM1LMNAPOLB
SCHEMBL30089337 0.89 SLC22A12 (0.78) SLC22A12KDM4ECHRM1LMNATHRB
SCHEMBL28589808 0.88 SLC22A12 (1.00) SLC22A12KDM4ELMNARAB9ASMN1; SMN2
SCHEMBL30089245 0.88 SLC22A12 (0.74) SLC22A12KDM4ECHRM1LMNAHPGD
SCHEMBL28581670 0.88 SLC22A12 (0.74) SLC22A12KDM4ECHRM1LMNAHPGD
SCHEMBL28578369 0.86 SLC22A12 (0.74) SLC22A12KDM4E

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
CN-113004187-B Compound with function of inhibiting activity of organic anion transporter 1, preparation method and application 沈阳药科大学 2022-09-20 CN disclosed