SCHEMBL2812988

SCHEMBL2812988

Cc1c(Cl)cccc1NC(=O)Nc1[nH]c(Cc2ccc(C(=O)O)o2)nc1C(N)=O

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.45
POLB P06746 2/20 0.45
KDM4E B2RXH2 1/20 0.44
FBP1 P09467 1/20 0.43
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
RAB9A P51151 1/20 0.40
MAPT P10636 3/20 0.39
ALDH1A1 P00352 2/20 0.39
TRPV1 Q8NER1 2/20 0.38
LMNA P02545 1/20 0.37
THRB P10828 1/20 0.37

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
SCHEMBL2815376 0.89 SMN1; SMN2 (0.53) SMN1; SMN2POLBKDM4EKMT2AMEN1
SCHEMBL2812983 0.84 FBP1 (0.47) SMN1; SMN2FBP1KMT2AALDH1A1
SCHEMBL2814384 0.82 FBP1 (0.46) SMN1; SMN2FBP1KMT2AMEN1RAB9A
SCHEMBL2816377 0.82 FBP1 (0.45) POLBFBP1KMT2AMEN1RAB9A
SCHEMBL2814552 0.82 FBP1 (0.46) FBP1KMT2ARAB9AALDH1A1
SCHEMBL2816853 0.81 FBP1 (0.43) SMN1; SMN2POLBFBP1KMT2AMEN1
SCHEMBL2817159 0.81 FBP1 (0.48) SMN1; SMN2POLBFBP1KMT2AMEN1
SCHEMBL3992247 0.80 FBP1 (0.45) FBP1
SCHEMBL2815726 0.80 FBP1 (0.46) SMN1; SMN2FBP1KMT2AMEN1RAB9A
SCHEMBL2816512 0.80 FBP1 (0.46) SMN1; SMN2POLBKDM4EFBP1KMT2A

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 SMN1; SMN2 3994/4885POLB 2686/4885KDM4E 506/4885

“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.