SCHEMBL830078

SCHEMBL830078

CCOc1nc(-c2ccc(Cl)c(Cl)c2)cc(C(F)(F)F)c1C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
KMO O15229 6/20 0.46
EIF4E P06730 7/20 0.45
TTR P02766 1/20 0.44
AKR1C3 P42330 2/20 0.43
AKR1C2 P52895 2/20 0.43

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
SCHEMBL832584 0.89 ALDH1A1 (0.50) ALDH1A1L3MBTL1KMO
SCHEMBL831794 0.87 KMO (0.43) ALDH1A1L3MBTL1KMOEIF4ETTR
SCHEMBL831092 0.86 KMO (0.42) ALDH1A1L3MBTL1KMOEIF4ETTR
SCHEMBL830425 0.85 ALDH1A1 (0.51) ALDH1A1L3MBTL1
SCHEMBL829626 0.83 ALDH1A1 (0.50) ALDH1A1L3MBTL1KMOAKR1C3AKR1C2
SCHEMBL830844 0.81 ALDH1A1 (0.49) ALDH1A1L3MBTL1KMO
SCHEMBL831894 0.79 KMO (0.43) ALDH1A1L3MBTL1KMO
SCHEMBL831698 0.79 KMO (0.43) ALDH1A1L3MBTL1KMO
SCHEMBL829557 0.77 XDH (0.45) ALDH1A1L3MBTL1KMO
SCHEMBL832846 0.76 MAPT (0.43) ALDH1A1L3MBTL1KMO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8143411-B2 Substituted 6-phenylnicotinic acids and their use BAYER ANIMAL HEALTH GMBH (DE) 2012-03-27 US disclosed
US-8143411-B2 Substituted 6-phenylnicotinic acids and their use BAYER ANIMAL HEALTH GMBH (DE) 2012-03-27 US disclosed
US-8143411-B2 Substituted 6-phenylnicotinic acids and their use BAYER ANIMAL HEALTH GMBH (DE) 2012-03-27 US disclosed
US-20100234432-A1 Substituted 6-phenylnicotinic acids and their use BAYER ANIMAL HEALTH GMBH (DE) 2010-09-16 US disclosed
US-20100234432-A1 Substituted 6-phenylnicotinic acids and their use BAYER ANIMAL HEALTH GMBH (DE) 2010-09-16 US disclosed
US-20100234432-A1 Substituted 6-phenylnicotinic acids and their use BAYER ANIMAL HEALTH GMBH (DE) 2010-09-16 US disclosed
WO-2009033561-A1 SUBSTITUTED 6-PHEYLNICOTINIC ACIDS AND THE USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2009-03-19 WO 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-20100234432-A1 Substituted 6-phenylnicotinic acids and their use SLC5A6, FABP3, NAPRT ALDH1A1 1238/4885L3MBTL1 823/4885KMO 2954/4885

“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.