SCHEMBL11915765

SCHEMBL11915765

Cc1cc(-c2cc(-c3ccc(NCC4CCOCC4)cc3C)nc(=O)[nH]2)ccc1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIM1 P11309 2/20 0.47
▸ CDC7 O00311 1/20 0.47
▸ CSNK2A2 P19784 1/20 0.47
▸ CLK1 P49759 1/20 0.47
▸ GSK3B P49841 1/20 0.47
▸ CSNK2B P67870 1/20 0.47
▸ CSNK2A1 P68400 1/20 0.47
▸ CSNK2A3 Q8NEV1 1/20 0.47
▸ RIPK2 O43353 1/20 0.37
▸ GPR84 Q9NQS5 1/20 0.36
▸ PIK3CA P42336 2/20 0.36
▸ MTOR P42345 2/20 0.36
▸ EGLN1 Q9GZT9 2/20 0.35
▸ CSF1R P07333 2/20 0.35
▸ TTK P33981 2/20 0.34
▸ PAK1 Q13153 1/20 0.34
▸ CXCL12 P48061 1/20 0.34
▸ PTGS1 P23219 1/20 0.34
▸ PTGS2 P35354 1/20 0.34
▸ SYK P43405 1/20 0.34

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
SCHEMBL3331234 0.93 PIM1 (0.50) PIM1CDC7CSNK2A2CLK1GSK3B
SCHEMBL4555662 0.83 VCP (0.38) RIPK2GPR84TTKPTGS1PTGS2
SCHEMBL3330960 0.83 PIM1 (0.51) PIM1CDC7CSNK2A2CLK1GSK3B
SCHEMBL3331131 0.79 PIM1 (0.48) PIM1CDC7CSNK2A2CLK1GSK3B
SCHEMBL14037937 0.75 PIM1 (0.49) PIM1CDC7CSNK2A2CLK1GSK3B
SCHEMBL3329659 0.73 PIM1 (0.56) PIM1CDC7CSNK2A2CLK1GSK3B
SCHEMBL3329562 0.72 PIM1 (0.60) PIM1CDC7CSNK2A2CLK1GSK3B
SCHEMBL3329852 0.72 PIM1 (0.60) PIM1CDC7CSNK2A2CLK1GSK3B
SCHEMBL3329486 0.72 PIM1 (0.52) PIM1CDC7CSNK2A2CLK1GSK3B
SCHEMBL3329768 0.72 BRD4 (0.38) PIM1CSNK2A2CSNK2B

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-8242129-B2 6-phenylpyrimidinones as PIM modulators EXELIXIS, INC. (US) 2012-08-14 — — US disclosed
US-8242129-B2 6-phenylpyrimidinones as PIM modulators EXELIXIS, INC. (US) 2012-08-14 — — US disclosed
US-20100135954-A1 6-Phenylpyrimidinones as PIM Modulators EXELIXIS, INC. (US) 2010-06-03 — — US disclosed
US-20100135954-A1 6-Phenylpyrimidinones as PIM Modulators EXELIXIS, INC. (US) 2010-06-03 — — 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-20100135954-A1 6-Phenylpyrimidinones as PIM Modulators PIM1, PIM2, PIM3 PIM1 1/4885CDC7 3813/4885CSNK2A2 61/4885

“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.

Send feedback