SCHEMBL9979238

SCHEMBL9979238

COc1ncccc1-c1cccc(-c2nc(NCCO)c3ccncc3n2)c1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LATS1 O95835 17/20 0.61
LATS2 Q9NRM7 11/20 0.61
LMNA P02545 2/20 0.53
ALDH1A1 P00352 1/20 0.53
HPGD P15428 1/20 0.53
PRKCH P24723 1/20 0.47
PRKCE Q02156 1/20 0.47
PRKCD Q05655 1/20 0.47
MAPK1 P28482 2/20 0.45
MEN1 O00255 1/20 0.45
USP2 O75604 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
TSHR P16473 1/20 0.45
CYP2C19 P33261 1/20 0.45
KMT2A Q03164 1/20 0.45
CLK4 Q9HAZ1 1/20 0.45

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
SCHEMBL12039897 0.88 CYP1A2 (0.55) LATS1LATS2LMNAALDH1A1MAPK1
SCHEMBL12039884 0.88 LATS1 (0.61) LATS1LATS2LMNAALDH1A1HPGD
SCHEMBL9979316 0.85 CYP1A2 (0.54) LATS1LATS2LMNAALDH1A1MAPK1
SCHEMBL9979400 0.78 CYP1A2 (0.48) LATS1LATS2LMNAALDH1A1MAPK1
SCHEMBL20574643 0.77 LATS1 (1.00) LATS1LATS2LMNAALDH1A1HPGD
SCHEMBL29650626 0.77 LATS1 (1.00) LATS1LATS2LMNAALDH1A1HPGD
SCHEMBL9979110 0.76 CYP1A2 (0.52) LATS1LATS2LMNAALDH1A1MAPK1
SCHEMBL14475071 0.71 CYP1A2 (0.58) LMNAALDH1A1HPGDMAPK1MEN1
SCHEMBL12058167 0.69 GBA1 (0.41) LATS1LATS2LMNAALDH1A1MAPK1
SCHEMBL9979050 0.69 GBA1 (0.42) LATS1LATS2LMNAALDH1A1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110319409-A1 7-AZA-QUINAZOLINE PDE10 INHIBITORS COX CHRISTOPHER D (US) 2011-12-29 US claimed
US-20110319409-A1 7-AZA-QUINAZOLINE PDE10 INHIBITORS COX CHRISTOPHER D (US) 2011-12-29 US disclosed
US-20110319409-A1 7-AZA-QUINAZOLINE PDE10 INHIBITORS COX CHRISTOPHER D (US) 2011-12-29 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-20110319409-A1 7-AZA-QUINAZOLINE PDE10 INHIBITORS PDE5A, PDE12, PDE7B LATS1 4435/4885LATS2 4167/4885LMNA 3274/4885

“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.