SCHEMBL5089081

SCHEMBL5089081

Cc1cc(NC(=O)C(CC(=O)O)c2cc(C(=N)NO)ccc2OCc2ccccc2)ccc1C(=O)N1CCCC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.40
MET P08581 3/20 0.39
HSD17B10 Q99714 1/20 0.38
HPGD P15428 3/20 0.38
MAPT P10636 2/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
ALDH1A1 P00352 1/20 0.38
ATM Q13315 1/20 0.38
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
F10 P00742 3/20 0.36
PRSS1 P07477 2/20 0.36
ACP1 P24666 1/20 0.35
PTPN12 Q05209 1/20 0.35
PTPN13 Q12923 1/20 0.35
SSU72 Q9NP77 1/20 0.35
F2 P00734 1/20 0.35
PRSS2 P07478 1/20 0.35
F7 P08709 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
SCHEMBL5091455 0.89 HSD11B1 (0.41) SMN1; SMN2HSD17B10HPGDMAPTNPC1
SCHEMBL5093101 0.85 SMN1; SMN2 (0.41) SMN1; SMN2METHPGDNPC1RAB9A
SCHEMBL7370559 0.82 MET (0.41) SMN1; SMN2METHSD17B10HPGDMAPT
SCHEMBL6554470 0.76 SMPD1 (0.43) SMN1; SMN2HSD17B10HPGDMAPTNPC1
SCHEMBL7116842 0.75 MET (0.45) METHSD17B10NPC1RAB9AACP1
SCHEMBL6819055 0.75 F10 (0.44) F10PRSS1F2PRSS2F7
Hydrochloric Acid SCHEMBL6841506 0.74 F10 (0.44) F10PRSS1F2PRSS2F7
SCHEMBL5094227 0.74 MET (0.41) SMN1; SMN2METHSD17B10HPGDMAPT
SCHEMBL6324410 0.74 HSD17B10 (0.38) SMN1; SMN2HSD17B10HPGDMAPTNPC1
SCHEMBL5089072 0.73 HSD17B10 (0.38) SMN1; SMN2HSD17B10HPGDMAPTNPC1

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-7425641-B2 Carboxylic acid amides, the preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA KG (DE) 2008-09-16 US disclosed
US-20050065346-A1 Carboxylic acid amides, the preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA KG (DE) 2005-03-24 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-20050065346-A1 Carboxylic acid amides, the preparation thereof and their use as pharmaceutical compositions F12, F11, F2 SMN1; SMN2 2093/4885MET 2804/4885HSD17B10 1622/4885

“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.