SCHEMBL2817159

SCHEMBL2817159

CCc1ccc(NC(=O)Nc2[nH]c(Cc3ccc(C(=O)O)o3)nc2C(N)=O)cc1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 1/20 0.48
RAB9A P51151 7/20 0.42
NPC1 O15118 6/20 0.40
KMT2A Q03164 5/20 0.39
SMN1; SMN2 Q16637 3/20 0.36
MEN1 O00255 3/20 0.36
MAPT P10636 2/20 0.36
USP2 O75604 1/20 0.36
TP53 P04637 1/20 0.36
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36
ALOX15 P16050 1/20 0.36
HTT P42858 1/20 0.36
HSD17B10 Q99714 1/20 0.36
GHSR Q92847 1/20 0.36
STING1 Q86WV6 1/20 0.35
PKM P14618 1/20 0.35
ATM Q13315 1/20 0.35

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
SCHEMBL3989886 0.91 FBP1 (0.45) FBP1RAB9ANPC1KMT2AMEN1
SCHEMBL3993827 0.91 FBP1 (0.45) FBP1RAB9ANPC1KMT2AMEN1
SCHEMBL2814384 0.90 FBP1 (0.46) FBP1RAB9ANPC1KMT2ASMN1; SMN2
SCHEMBL2816512 0.89 FBP1 (0.46) FBP1RAB9ANPC1KMT2ASMN1; SMN2
SCHEMBL17957238 0.89 RAB9A (0.39) FBP1RAB9ANPC1KMT2ASMN1; SMN2
SCHEMBL2815430 0.87 FBP1 (0.50) FBP1SMN1; SMN2MAPTHTT
SCHEMBL2814552 0.87 FBP1 (0.46) FBP1RAB9ANPC1KMT2AGAA
SCHEMBL17957271 0.87 RAB9A (0.44) RAB9ANPC1KMT2ASMN1; SMN2MEN1
SCHEMBL2812272 0.87 NPC1 (0.46) FBP1RAB9ANPC1KMT2AMEN1
SCHEMBL2812983 0.84 FBP1 (0.47) FBP1KMT2ASMN1; SMN2GAAPKM

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
EP-2193122-B1 IMIDAZOLE DERIVATIVES MERCK PATENT GMBH (DE) 2016-08-03 EP claimed
US-20100249132-A1 IMIDAZOLE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2010-09-30 US claimed
EP-2193122-B1 IMIDAZOLE DERIVATIVES MERCK PATENT GMBH (DE) 2016-08-03 EP disclosed

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 FBP1 2186/4885RAB9A 882/4885NPC1 1554/4885

“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.