SCHEMBL2285157

SCHEMBL2285157

O=C(Nc1cccc(F)n1)c1cc(-c2ccc(O)cc2)nc2ccccc12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.60
CYP3A4 P08684 3/20 0.58
MEN1 O00255 5/20 0.57
KMT2A Q03164 5/20 0.57
GFER P55789 1/20 0.57
KDM4E B2RXH2 5/20 0.56
HPGD P15428 5/20 0.56
TSHR P16473 2/20 0.56
HSD17B10 Q99714 2/20 0.56
USP2 O75604 1/20 0.56
MAPK1 P28482 1/20 0.56
PTGER4 P35408 1/20 0.56
L3MBTL1 Q9Y468 2/20 0.55
MAPT P10636 5/20 0.55
ALDH1A1 P00352 4/20 0.54
CYP2C9 P11712 1/20 0.54
TACR3 P29371 2/20 0.53
LMNA P02545 3/20 0.53
GLA P06280 1/20 0.53
GAA P10253 1/20 0.53

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
SCHEMBL2286089 0.91 ALDH1A1 (0.62) POLBCYP3A4MEN1KMT2AGFER
SCHEMBL2285437 0.89 DHODH (0.55) POLBCYP3A4MEN1KMT2AGFER
SCHEMBL2286108 0.87 CYP3A4 (0.69) CYP3A4MEN1KMT2AKDM4EHPGD
SCHEMBL2281123 0.86 MEN1 (0.62) POLBCYP3A4MEN1KMT2AGFER
SCHEMBL2288986 0.86 AURKA (0.47) POLBCYP3A4MEN1KMT2AGFER
SCHEMBL2283172 0.83 KDM4E (0.68) POLBCYP3A4MEN1KMT2AKDM4E
SCHEMBL2281113 0.83 MAPT (0.64) POLBMEN1KMT2AKDM4EHPGD
SCHEMBL2292084 0.77 TACR3 (0.57) CYP3A4MEN1KMT2AKDM4EMAPT
SCHEMBL2285427 0.77 PLA2G2A (0.67) CYP3A4MEN1KMT2AKDM4EMAPT
SCHEMBL3237037 0.76 POLB (1.00) POLBKMT2AKDM4EHPGDALDH1A1

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-20110207773-A1 NOVEL PHENYL-QUINOLINE-CARBOXYLIC ACID PYRIDINE DERIVATIVES USEFUL AS MODULATORS OF NICOTINIC ACETYLCHOLINE RECEPTORS NEUROSEARCH A/S (DK) 2011-08-25 US claimed
US-20110207773-A1 NOVEL PHENYL-QUINOLINE-CARBOXYLIC ACID PYRIDINE DERIVATIVES USEFUL AS MODULATORS OF NICOTINIC ACETYLCHOLINE RECEPTORS NEUROSEARCH A/S (DK) 2011-08-25 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-20110207773-A1 NOVEL PHENYL-QUINOLINE-CARBOXYLIC ACID PYRIDINE DERIVATIVES USEFUL AS MODULATORS OF NICOTINIC ACETYLCHOLINE RECEPTORS CHRNA5, CHRNA10, CHRNA6 POLB 3715/4885CYP3A4 1663/4885MEN1 4175/4885

“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.