Sugi Predict

Sugi Predict / Compounds / SCHEMBL704903

SCHEMBL704903

SCHEMBL704903

Cc1cccc([C@H](C)c2nccn2Cc2ccc(S(C)(=O)=O)cc2)c1C

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.40
▸ LIMK2 P53671 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ KCNH2 Q12809 2/20 0.36
▸ CYP11B2 P19099 1/20 0.36
▸ PTGDR2 Q9Y5Y4 2/20 0.36
▸ CYP1A2 P05177 1/20 0.35
▸ CYP2D6 P10635 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ CYP3A4 P08684 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ ADORA2A P29274 1/20 0.34
▸ ADORA1 P30542 1/20 0.34
▸ AGTR2 P50052 1/20 0.33

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
SCHEMBL703762 0.86 TDP1 (0.44) TDP1LMNAKCNH2CYP11B2CYP1A2
SCHEMBL697205 0.85 TDP1 (0.44) TDP1LMNAKCNH2CYP1A2CYP2D6
SCHEMBL696289 0.85 TDP1 (0.54) TDP1LMNAKCNH2CYP1A2CYP2D6
SCHEMBL695900 0.85 TDP1 (0.54) TDP1LMNAKCNH2CYP1A2CYP2D6
SCHEMBL697990 0.84 TDP1 (0.46) TDP1LMNAKCNH2CYP1A2CYP2D6
SCHEMBL698831 0.84 TDP1 (0.43) TDP1LMNAKCNH2CYP1A2CYP2D6
SCHEMBL698832 0.83 TDP1 (0.44) TDP1LMNAKCNH2CYP1A2CYP2D6
SCHEMBL697359 0.83 TDP1 (0.47) TDP1LMNACYP11B2CYP1A2CYP2D6
SCHEMBL697409 0.82 CYP1A2 (0.54) TDP1LMNACYP1A2CYP2D6CYP2C19
SCHEMBL697649 0.82 CYP1A2 (0.54) TDP1LMNACYP1A2CYP2D6CYP2C19

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 TDP1 2820/4885LIMK2 1581/4885LMNA 3030/4885
US-20090312326-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 TDP1 2820/4885LIMK2 1581/4885LMNA 3030/4885
US-20070167506-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 TDP1 2820/4885LIMK2 1581/4885LMNA 3030/4885
US-20080119536-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 TDP1 2820/4885LIMK2 1581/4885LMNA 3030/4885

“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.