SCHEMBL4358367

SCHEMBL4358367

FC(F)(F)Oc1ccc(-c2cc(N3CCCCC3)cc(-c3ccc(OC(F)(F)F)cc3)n2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.50
HSD17B10 Q99714 3/20 0.50
ALDH1A1 P00352 3/20 0.50
HPGD P15428 1/20 0.50
ACP1 P24666 2/20 0.47
TP53 P04637 3/20 0.47
MAPT P10636 3/20 0.47
MAPK1 P28482 4/20 0.45
GALR2 O43603 2/20 0.44
S1PR1 P21453 1/20 0.44
SCN5A Q14524 1/20 0.43
ADORA3 P0DMS8 1/20 0.42
CCR6 P51684 1/20 0.42
LMNA P02545 1/20 0.41
THRB P10828 1/20 0.41
GAA P10253 2/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
GALR1 P47211 1/20 0.41
MAOA P21397 1/20 0.41

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
SCHEMBL3998850 0.87 GALR2 (0.57) ACP1TP53MAPTGALR2GALR1
SCHEMBL4130166 0.83 GALR2 (0.53) KDM4EHSD17B10ALDH1A1ACP1TP53
SCHEMBL4356830 0.81 GALR2 (0.57) HSD17B10ACP1TP53MAPTMAPK1
SCHEMBL4001751 0.81 GALR2 (0.52) KDM4EHSD17B10ALDH1A1TP53MAPT
SCHEMBL21434101 0.80 KMT2A (0.61) KDM4EHSD17B10ALDH1A1HPGDACP1
SCHEMBL3996030 0.80 GALR2 (0.55) HSD17B10ACP1TP53MAPK1GALR2
SCHEMBL28161315 0.80 EPHX2 (0.50) KDM4EHSD17B10ALDH1A1TP53MAPT
SCHEMBL4291900 0.79 HSD17B10 (0.41) KDM4EHSD17B10ALDH1A1HPGDACP1
SCHEMBL3998726 0.79 KDM4E (0.58) KDM4EHSD17B10ALDH1A1HPGDTP53
SCHEMBL21434184 0.78 GALR2 (0.53) KDM4EHSD17B10ALDH1A1HPGDACP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060084644-A1 Novel pyridine compounds, process for their preparation and compositions containing them DR. REDDY'S LABORATORIES LTD. (IN) 2006-04-20 US claimed
US-7622486-B2 Pyridine compounds, process for their preparation and compositions containing them REDDY US THERAPEUTICS, INC. (US) 2009-11-24 US disclosed
US-7622486-B2 Pyridine compounds, process for their preparation and compositions containing them REDDY US THERAPEUTICS, INC. (US) 2009-11-24 US disclosed
US-7622486-B2 Pyridine compounds, process for their preparation and compositions containing them REDDY US THERAPEUTICS, INC. (US) 2009-11-24 US disclosed
US-20060084644-A1 Novel pyridine compounds, process for their preparation and compositions containing them DR. REDDY'S LABORATORIES LTD. (IN) 2006-04-20 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-20060084644-A1 Novel pyridine compounds, process for their preparation and compositions containing them LDLR, LRP6, PLPBP KDM4E 1937/4885HSD17B10 3093/4885ALDH1A1 3749/4885

“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.