SCHEMBL832247

SCHEMBL832247

CCOC(=O)C1=C(C(F)(F)F)NC(c2ccc(Cl)cc2)CC1=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2B P29275 2/20 0.45
ABCC1 P33527 1/20 0.44
ALOX12 P18054 2/20 0.43
HTT P42858 2/20 0.43
LMNA P02545 1/20 0.43
GAA P10253 2/20 0.43
ALDH1A1 P00352 1/20 0.43
SMN1; SMN2 Q16637 3/20 0.42
MAPT P10636 2/20 0.42
NPSR1 Q6W5P4 4/20 0.41
HPGD P15428 2/20 0.41
TSHR P16473 1/20 0.41
TP53 P04637 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA7 P43166 1/20 0.40

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
SCHEMBL1703162 0.73 ABCC1 (0.49) ABCC1ALOX12HTTLMNAGAA
SCHEMBL12011131 0.70 ABCC1 (0.48) ABCC1ALOX12HTTLMNAGAA
SCHEMBL1702689 0.68 ABCC1 (0.46) ABCC1ALOX12HTTLMNAGAA
SCHEMBL1702687 0.68 ABCC1 (0.46) ABCC1ALOX12HTTLMNAGAA
SCHEMBL831379 0.68 GPBAR1 (0.52) MAPTTSHRMEN1KMT2A
SCHEMBL25412531 0.68 ADORA2B (0.38) ADORA2BGAAALDH1A1HPGDKDM4E
SCHEMBL30299426 0.68 ADORA2B (0.38) ADORA2BGAAALDH1A1HPGDKDM4E
SCHEMBL832583 0.68 HPGD (0.41) LMNAGAAALDH1A1SMN1; SMN2MAPT
SCHEMBL10333289 0.68 ALDH1A1 (0.46) ADORA2BABCC1ALOX12LMNAGAA
SCHEMBL5340705 0.66 HSD17B10 (0.75) ADORA2BABCC1HTTGAAALDH1A1

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 ADORA2B 1971/4885ABCC1 159/4885ALOX12 1122/4885

“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.