SCHEMBL5436772

SCHEMBL5436772

NC(=O)Nc1ccc(-c2ccc(Br)c(F)c2)cc1F

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 3/20 1.00
DHODH Q02127 1/20 0.46
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
HPGD P15428 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
ABCB1 P08183 4/20 0.43
HTT P42858 3/20 0.42
EGFR P00533 1/20 0.41
CA1 P00915 3/20 0.41
CA2 P00918 3/20 0.41
CA9 Q16790 3/20 0.41
CA12 O43570 2/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.40
ABCC1 P33527 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
SCHEMBL5428680 0.83 KIF11 (0.71) KIF11DHODHNPC1RAB9ASMN1; SMN2
SCHEMBL31068310 0.80 KIF11 (0.66) KIF11NPC1RAB9ASMN1; SMN2HPGD
SCHEMBL5428786 0.80 KIF11 (0.66) KIF11NPC1RAB9ASMN1; SMN2HPGD
SCHEMBL5428273 0.79 KIF11 (0.66) KIF11NPC1RAB9ASMN1; SMN2HPGD
SCHEMBL5431573 0.79 KIF11 (0.66) KIF11RAB9AABCB1HTTCA1
SCHEMBL30343207 0.79 KIF11 (0.65) KIF11NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL2367225 0.79 KIF11 (0.65) KIF11NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL5422208 0.78 KIF11 (1.00) KIF11ABCB1
SCHEMBL5428342 0.78 KIF11 (0.74) KIF11
SCHEMBL8859930 0.78 KIF11 (0.63) KIF11NPC1RAB9ASMN1; SMN2HPGD

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-20070265345-A1 Novel Biphenyl Compounds And Their Use SMITHKLINE BEECHAM CORPORATION (US) 2007-11-15 US claimed
US-20070265345-A1 Novel Biphenyl Compounds And Their Use SMITHKLINE BEECHAM CORPORATION (US) 2007-11-15 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-20070265345-A1 Novel Biphenyl Compounds And Their Use KIF5B, KIF5C, KIF5A KIF11 8/4885DHODH 1660/4885NPC1 638/4885

“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.