SCHEMBL3301556

SCHEMBL3301556

COc1ccc(CNc2nc3c(c(=O)n2-c2ccccc2)CN(C(=O)Nc2ccccc2OC(F)(F)F)CC3)cc1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PRLHR P49683 8/20 0.43
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
CLPP Q16740 1/20 0.40
MAPT P10636 3/20 0.40
POLB P06746 2/20 0.40
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 1/20 0.39
HPGD P15428 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
RECQL P46063 1/20 0.38
PDE5A O76074 2/20 0.38
TAS1R3 Q7RTX0 1/20 0.38
TAS1R1 Q7RTX1 1/20 0.38
TAS1R2 Q8TE23 1/20 0.38

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
SCHEMBL3296546 0.90 PRLHR (0.46) PRLHRMEN1KMT2ACLPPMAPT
SCHEMBL3299790 0.90 RECQL (0.46) PRLHRCLPPMAPTALDH1A1RECQL
SCHEMBL3296765 0.90 PRLHR (0.46) PRLHRMEN1KMT2ACLPPMAPT
SCHEMBL3298250 0.88 PRLHR (0.45) PRLHRKMT2ACLPPMAPTPOLB
SCHEMBL3295383 0.88 PRLHR (0.49) PRLHRMEN1KMT2ACLPPMAPT
SCHEMBL3300796 0.87 PRLHR (0.44) PRLHRMEN1KMT2ACLPPMAPT
SCHEMBL3296568 0.87 PRLHR (0.45) PRLHRMEN1KMT2ACLPPMAPT
SCHEMBL3296948 0.87 PRLHR (0.44) PRLHRMEN1KMT2ACLPPMAPT
SCHEMBL3301167 0.86 PRLHR (0.48) PRLHRCLPPMAPTALDH1A1RECQL
SCHEMBL3300481 0.86 PRLHR (0.45) PRLHRMEN1KMT2ACLPPMAPT

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-8232282-B2 Compound having bicyclic pyrimidine structure and pharmaceutical composition comprising the same DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2012-07-31 US disclosed
US-20100093771-A1 Compound having bicyclic pyrimidine structure and pharmaceutical composition comprising the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-04-15 US disclosed
EP-2078719-A1 COMPOUND HAVING BICYCLIC PYRIMIDINE STRUCTURE AND PHARMACEUTICAL COMPOSITION COMPRISING THE COMPOUND Dainippon Sumitomo Pharma Co., Ltd. (JP) 2009-07-15 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-20100093771-A1 Compound having bicyclic pyrimidine structure and pharmaceutical composition comprising the same GART, MGAT2, MGAT1 PRLHR 3093/4885MEN1 2200/4885KMT2A 297/4885

“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.