Sugi Predict

Sugi Predict / Compounds / SCHEMBL698285

SCHEMBL698285

SCHEMBL698285

Cc1cccc([C@H](C)c2nccn2Cc2ccc(F)cc2C(F)(F)F)c1C

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ P2RX7 Q99572 6/20 0.42
▸ ADRA2C P18825 1/20 0.34
▸ KCNH2 Q12809 2/20 0.34
▸ IDO1 P14902 2/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ DHFR P00374 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ HIF1A Q16665 1/20 0.33
▸ NR1H2 P55055 1/20 0.33
▸ NR1H3 Q13133 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ OPRK1 P41145 2/20 0.33
▸ NTRK1 P04629 1/20 0.32

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
SCHEMBL702942 0.92 P2RX7 (0.44) P2RX7ADRA2CKCNH2ALDH1A1MAPT
SCHEMBL697472 0.87 ADRA2C (0.41) P2RX7ADRA2CKCNH2ALDH1A1TDP1
SCHEMBL695870 0.87 PPARG (0.38) P2RX7ADRA2CKCNH2ALDH1A1MAPT
SCHEMBL696426 0.85 CYP2D6 (0.45) P2RX7KCNH2ALDH1A1CYP2D6TSHR
SCHEMBL696898 0.85 KCNH2 (0.38) P2RX7ADRA2CKCNH2ALDH1A1MAPT
SCHEMBL697746 0.82 P2RX7 (0.39) P2RX7KCNH2TDP1KMT2A
SCHEMBL697757 0.81 TDP1 (0.41) ALDH1A1TDP1KMT2A
SCHEMBL3530799 0.81 ADRA2C (0.38) P2RX7ADRA2CKCNH2ALDH1A1MAPT
SCHEMBL697990 0.80 TDP1 (0.46) P2RX7KCNH2CYP2D6CYP2C19TDP1
SCHEMBL699063 0.80 ADRA2C (0.42) ADRA2CKCNH2ALDH1A1MAPTCYP2D6

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 9 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
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 P2RX7 671/4885ADRA2C 144/4885KCNH2 277/4885
US-20090312326-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 P2RX7 671/4885ADRA2C 144/4885KCNH2 277/4885
US-20070167506-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 P2RX7 671/4885ADRA2C 144/4885KCNH2 277/4885
US-20080119536-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 P2RX7 671/4885ADRA2C 144/4885KCNH2 277/4885

“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.