SCHEMBL2819129

SCHEMBL2819129

NC(=O)c1nc(-c2ccc(CC(=O)O)cc2)[nH]c1NC(=O)Nc1cccc(Cl)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.47
KMT2A Q03164 5/20 0.47
MAPT P10636 4/20 0.47
LMNA P02545 3/20 0.47
HTT P42858 3/20 0.47
NPC1 O15118 3/20 0.47
RAB9A P51151 2/20 0.47
ADORA2B P29275 1/20 0.47
ADORA1 P30542 1/20 0.47
NTRK2 Q16620 2/20 0.46
NTRK1 P04629 1/20 0.46
ALDH1A1 P00352 1/20 0.44
KDM4E B2RXH2 1/20 0.43
KIT P10721 2/20 0.42
KDR P35968 2/20 0.42
FLT3 P36888 2/20 0.42
IGF1R P08069 1/20 0.42
CDK4 P11802 1/20 0.42
CCND1 P24385 1/20 0.42
MET P08581 1/20 0.41

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
SCHEMBL2812209 0.89 MEN1 (0.44) MEN1KMT2AKDM4EKDR
SCHEMBL2816747 0.83 DGAT1 (0.44) MEN1KMT2AKDM4EKDR
SCHEMBL2818258 0.82 KIF11 (0.43) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL2812631 0.80 EPHX2 (0.44) MEN1KMT2AMAPTCA12CA1
SCHEMBL2815628 0.75 MAPT (0.44) MEN1KMT2AMAPTLMNAHTT
SCHEMBL2812896 0.74 NPC1 (0.55) MEN1KMT2AMAPTLMNAHTT
SCHEMBL3989807 0.73 FFAR1 (0.58) MAPTLMNAHTTNPC1RAB9A
SCHEMBL3993080 0.73 NR1H4 (0.46) KMT2ANPC1RAB9A
SCHEMBL3994385 0.73 NR1H4 (0.46) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL2815632 0.72 KDR (0.46) MEN1KMT2AMAPTLMNAHTT

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-20100249132-A1 IMIDAZOLE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2010-09-30 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100249132-A1 IMIDAZOLE DERIVATIVES SDHA, SDHB, TPD52L2 MEN1 171/4885KMT2A 1034/4885MAPT 3810/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.