SCHEMBL19083039

SCHEMBL19083039

CC(C)(C)c1ccc2c(-c3cc(C(F)(F)F)n[nH]3)nccc2c1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.38
GRM4 Q14833 8/20 0.37
CYP1A2 P05177 1/20 0.35
CYP2C19 P33261 1/20 0.35
SCN9A Q15858 10/20 0.35
MITF O75030 1/20 0.33
ALDH1A1 P00352 1/20 0.33
TP53 P04637 1/20 0.33
KMT2A Q03164 1/20 0.33
CYP3A4 P08684 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
SCHEMBL15871669 0.85 GRM4 (0.38) GRM4CYP1A2CYP2C19KMT2A
SCHEMBL2948463 0.80 KDM4E (0.51) GRM4CYP1A2CYP2C19ALDH1A1KMT2A
SCHEMBL1476570 0.76 PIM1 (0.35) KIF11GRM4MITFALDH1A1TP53
SCHEMBL19083038 0.75 GRM4 (0.35) GRM4CYP1A2CYP2C19SCN9AKMT2A
SCHEMBL2945434 0.75 KDM4E (0.51) GRM4CYP1A2CYP2C19ALDH1A1KMT2A
SCHEMBL15871661 0.75 GRM4 (0.32) GRM4CYP1A2CYP2C19CYP3A4
SCHEMBL19083040 0.73 CYP17A1 (0.34) KIF11MITFALDH1A1TP53KMT2A
SCHEMBL9051628 0.72 ALDH1A1 (0.61) KIF11MITFALDH1A1TP53KMT2A
SCHEMBL25443140 0.71 KMT2A (0.39) KIF11SCN9AALDH1A1KMT2A
SCHEMBL17254410 0.70 NPSR1 (0.40) KIF11MITFALDH1A1TP53KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170194578-A1 PLATINUM COMPLEX AND OLED USING THE SAME NATIONAL TSING HUA UNIVERSITY (TW) 2017-07-06 US disclosed
US-20170194578-A1 PLATINUM COMPLEX AND OLED USING THE SAME NATIONAL TSING HUA UNIVERSITY (TW) 2017-07-06 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-20170194578-A1 PLATINUM COMPLEX AND OLED USING THE SAME OCIAD2, POF1B, OCIAD1 KIF11 3327/4885GRM4 813/4885CYP1A2 604/4885

“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.