SCHEMBL698128

SCHEMBL698128

Cc1c(F)cccc1C(=O)c1ncc[nH]1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.56
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
F2RL1 P55085 2/20 0.48
GLA P06280 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
HTT P42858 1/20 0.46
ESR1 P03372 1/20 0.40
ESR2 Q92731 1/20 0.40
CSNK1A1 P48729 1/20 0.36
TYRO3 Q06418 1/20 0.36
DYRK1B Q9Y463 1/20 0.36
TAS1R3 Q7RTX0 1/20 0.36
TAS1R1 Q7RTX1 1/20 0.36
TAS1R2 Q8TE23 1/20 0.36
BRAF P15056 1/20 0.36
HDAC1 Q13547 1/20 0.36
ALDH1A1 P00352 1/20 0.35
ADRA2A P08913 1/20 0.35
ADRA1A P35348 1/20 0.35

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
SCHEMBL697995 0.85 KMT2A (0.59) KMT2ANPC1RAB9AF2RL1GLA
SCHEMBL722012 0.85 KMT2A (0.59) KMT2ANPC1RAB9AF2RL1GLA
SCHEMBL653632 0.84 KMT2A (0.67) KMT2ANPC1RAB9AF2RL1GLA
SCHEMBL703857 0.82 KMT2A (0.39) KMT2ANPC1RAB9AF2RL1GLA
SCHEMBL696920 0.80 KMT2A (0.51) KMT2ANPC1RAB9AF2RL1GLA
SCHEMBL27733634 0.79 KMT2A (0.52) KMT2ANPC1RAB9AF2RL1GLA
SCHEMBL27805818 0.79 KMT2A (0.77) KMT2ANPC1RAB9AF2RL1GLA
SCHEMBL28358852 0.78 KMT2A (0.67) KMT2ANPC1RAB9AF2RL1GLA
SCHEMBL10507087 0.77 NPC1 (0.55) KMT2ANPC1RAB9AF2RL1GLA
SCHEMBL697349 0.74 KMT2A (0.54) KMT2ANPC1RAB9AF2RL1GLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2423199-A1 Substituted imidazoles and their use as pesticides Pfizer Limited (GB) 2012-02-29 EP disclosed
EP-1981853-B1 SUBSTITUTED IMIDAZOLES AND THEIR USE AS PESTICIDES PFIZER LTD (GB) 2011-04-13 EP disclosed
US-7825149-B2 Substituted imidazoles PFIZER LIMITED (GB) 2010-11-02 US disclosed
US-20090312326-A1 SUBSTITUTED IMIDAZOLES PFIZER LIMITED (GB) 2009-12-17 US disclosed
US-7592362-B2 Substituted imidazoles PFIZER LIMITED (GB) 2009-09-22 US disclosed
US-7547718-B2 Substituted imidazoles PFIZER LIMITED (GB) 2009-06-16 US disclosed
US-7544706-B2 Substituted imidazoles PFIZER LIMITED (GB) 2009-06-09 US disclosed
US-20080125473-A1 SUBSTITUTED IMIDAZOLES PFIZER LIMITED (GB) 2008-05-29 US disclosed
US-20080119536-A1 SUBSTITUTED IMIDAZOLES PFIZER LIMITED (GB) 2008-05-22 US disclosed
US-20070167506-A1 SUBSTITUTED IMIDAZOLES PFIZER INC. (US) 2007-07-19 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 (4 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-20080125473-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 KMT2A 945/4885NPC1 745/4885RAB9A 777/4885
US-20090312326-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 KMT2A 945/4885NPC1 745/4885RAB9A 777/4885
US-20070167506-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 KMT2A 945/4885NPC1 745/4885RAB9A 777/4885
US-20080119536-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 KMT2A 945/4885NPC1 745/4885RAB9A 777/4885

“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.