SCHEMBL10134604

SCHEMBL10134604

Cc1cc2c(cc1OCc1ccccc1)[nH]c(=O)c1ccncc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 1/20 0.51
PARP1 P09874 5/20 0.46
CSNK2A1 P68400 2/20 0.46
CTSV O60911 2/20 0.44
CTSL P07711 2/20 0.44
CHEK1 O14757 2/20 0.44
LMNA P02545 1/20 0.43
MAOA P21397 2/20 0.42
GABRP O00591 2/20 0.39
GABRD O14764 2/20 0.39
GABRA1 P14867 2/20 0.39
GABRB1 P18505 2/20 0.39
GABRG2 P18507 2/20 0.39
GABRB3 P28472 2/20 0.39
GABRA5 P31644 2/20 0.39
GABRA3 P34903 2/20 0.39
GABRA2 P47869 2/20 0.39
GABRB2 P47870 2/20 0.39
GABRA4 P48169 2/20 0.39
GABRE P78334 2/20 0.39

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
SCHEMBL20581186 0.74 CTSV (0.61) KDM4CCSNK2A1CTSVCTSLLMNA
SCHEMBL16972650 0.72 AAK1 (0.63) PARP1CSNK2A1
SCHEMBL16972654 0.72 AAK1 (0.63) PARP1CSNK2A1
SCHEMBL8897431 0.72 GRIN2D (0.51) CTSVCTSLALDH1A1
SCHEMBL14968197 0.72 KDM4C (0.57) KDM4CPARP1CHEK1LMNAPDE5A
SCHEMBL690131 0.71 KDM4E (0.53) CTSVCTSLMAOAGABRA1GABRG2
SCHEMBL12663538 0.70 POLB (0.53) CTSVCTSLALDH1A1
SCHEMBL10134618 0.70 PARP1 (0.70) PARP1CSNK2A1GABRPGABRDGABRA1
SCHEMBL24121206 0.70 CTSL (0.50) KDM4CPARP1CSNK2A1CTSVCTSL
SCHEMBL14520678 0.69 IP6K1 (0.63) PARP1CHEK1LMNAADORA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120208792-A1 PROTEIN KINASE MODULATORS CYLENE PHARMACEUTICALS, INC. (US) 2012-08-16 US disclosed
US-20120208792-A1 PROTEIN KINASE MODULATORS CYLENE PHARMACEUTICALS, INC. (US) 2012-08-16 US disclosed
US-8168651-B2 Protein kinase modulators CYLENE PHARMACEUTICALS, INC. (US) 2012-05-01 US disclosed
US-8168651-B2 Protein kinase modulators CYLENE PHARMACEUTICALS, INC. (US) 2012-05-01 US disclosed
US-20090239859-A1 PROTEIN KINASE MODULATORS SENHWA BIOSCIENCES, INC. (TW) 2009-09-24 US disclosed
US-20090239859-A1 PROTEIN KINASE MODULATORS SENHWA BIOSCIENCES, INC. (TW) 2009-09-24 US disclosed
WO-2009108912-A1 PROTEIN KINASE MODULATORS CYLENE PHARMACEUTICALS, INC. (US) 2009-09-03 WO 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 (2 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-20120208792-A1 PROTEIN KINASE MODULATORS PIM1, PIM2, PIM3 KDM4C 1307/4885PARP1 690/4885CSNK2A1 680/4885
US-20090239859-A1 PROTEIN KINASE MODULATORS PIM1, PIM2, PIM3 KDM4C 1307/4885PARP1 690/4885CSNK2A1 680/4885

“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.