SCHEMBL3796477

SCHEMBL3796477

O=C(Cn1c(C(=O)O)nc2cc(C(=O)O)ccc21)Nc1ccc(Cl)cn1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 1/20 0.48
RAB9A P51151 8/20 0.46
NPC1 O15118 4/20 0.46
KMT2A Q03164 1/20 0.46
TDP1 Q9NUW8 1/20 0.45
ALDH1A1 P00352 2/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
TSHR P16473 4/20 0.44
L3MBTL1 Q9Y468 3/20 0.44
LMNA P02545 3/20 0.44
HTT P42858 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
MAPK1 P28482 2/20 0.42
TP53 P04637 2/20 0.42
MAPT P10636 1/20 0.42
PKM P14618 1/20 0.42
HPGD P15428 1/20 0.42
GLA P06280 1/20 0.42
POLB P06746 2/20 0.42
NFKB1 P19838 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
SCHEMBL3798321 0.92 F10 (0.48) F10RAB9ANPC1KMT2ATDP1
SCHEMBL3373231 0.87 F10 (0.42) F10RAB9ANPC1KMT2ATDP1
SCHEMBL3367236 0.86 F10 (0.61) F10RAB9ANPC1KMT2AALDH1A1
SCHEMBL3369253 0.83 GRM5 (0.43) F10KMT2AALDH1A1NPSR1MAPK1
SCHEMBL3374082 0.83 RAB9A (0.50) F10RAB9ANPC1TDP1ALDH1A1
SCHEMBL3369596 0.81 F10 (0.65) F10
SCHEMBL5880602 0.81 RAB9A (0.46) F10RAB9ANPC1KMT2ATDP1
SCHEMBL3369990 0.79 ACSS2 (0.45) F10RAB9ANPC1KMT2ATDP1
SCHEMBL3372806 0.77 RAB9A (0.50) F10RAB9ANPC1KMT2ATDP1
SCHEMBL3963940 0.76 F10 (0.52) F10RAB9ANPC1TDP1ALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7741341-B2 Benzimidazole-derivatives as factor Xa inhibitors SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2010-06-22 US disclosed
US-20050009829-A1 Benzimidazole-derivatives as factor Xa inhibitors AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2005-01-13 US 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-20050009829-A1 Benzimidazole-derivatives as factor Xa inhibitors F12, F11, F5 F10 11/4885RAB9A 1201/4885NPC1 3517/4885

“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.