SCHEMBL6415835

SCHEMBL6415835

CC(C)(C)NC(=O)c1ccc([N+](=O)[O-])c(F)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.55
GAA P10253 2/20 0.55
CTSK P43235 1/20 0.49
LMNA P02545 2/20 0.49
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
HTT P42858 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
GPR55 Q9Y2T6 1/20 0.49
ATM Q13315 2/20 0.49
TDP1 Q9NUW8 2/20 0.49
ALDH1A1 P00352 3/20 0.44
TTR P02766 2/20 0.44
HPGD P15428 2/20 0.43
HSP90AA1 P07900 1/20 0.43
POLB P06746 2/20 0.43
TSHR P16473 1/20 0.43

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
SCHEMBL5940574 0.86 MAPT (0.63) MAPTGAALMNACYP1A2CYP3A4
SCHEMBL6024367 0.84 ATM (0.51) MAPTGAACTSKLMNACYP1A2
SCHEMBL30871059 0.84 ATM (0.51) MAPTGAACTSKLMNACYP1A2
SCHEMBL4427078 0.83 HDAC6 (0.56) CTSKATMTDP1TTRCASP6
SCHEMBL24185865 0.81 HTT (0.56) GAACTSKHTTNPSR1ATM
SCHEMBL30663390 0.81 CTSK (0.48) MAPTCTSKLMNACYP1A2CYP3A4
SCHEMBL1418448 0.81 CTSK (0.54) MAPTGAACTSKLMNACYP1A2
SCHEMBL6416168 0.80 CHRNA1 (0.57) MAPTPOLBAPEX1
SCHEMBL6990289 0.79 MAPT (0.53) MAPTGAALMNACYP3A4TDP1
SCHEMBL11248434 0.79 ATM (0.56) MAPTCTSKATMTDP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6936736-B2 Amide derivative SUMITOMO MANUFACTURING COMPANY LIMITED (JP) 2005-08-30 US disclosed
US-20020147204-A1 Amide derivative SUMITOMO PHARMACEUTICALS COMPANY, LIMITED 2002-10-10 US disclosed
US-6384033-B1 DRUGS FOR VISION DEFECTS SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2002-05-07 US disclosed
EP-1034783-A1 AMIDE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2000-09-13 EP 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-20020147204-A1 Amide derivative ALDH1A2, NR1H2, HDAC3 MAPT 2510/4885GAA 3670/4885CTSK 3068/4885

“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.