SCHEMBL11916293

SCHEMBL11916293

CCNc1nc(Cl)nn2cccc12

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 1/20 0.44
TGFBR1 P36897 7/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
USP1 O94782 1/20 0.38
WDR48 Q8TAF3 1/20 0.38
PDE10A Q9Y233 1/20 0.38
MAP4K4 O95819 2/20 0.37
TGFBR2 P37173 5/20 0.36
RAD51 Q06609 1/20 0.35
LMNA P02545 1/20 0.34
POLB P06746 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
RXFP1 Q9HBX9 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
SCHEMBL24766437 0.84 IGF1R (0.41) IGF1RTGFBR1USP1WDR48MAP4K4
SCHEMBL11916292 0.83 TGFBR1 (0.39) TGFBR1ALDH1A1MAPTUSP1WDR48
SCHEMBL26698983 0.82 MAP4K4 (0.51) IGF1RTGFBR1MAP4K4TGFBR2
SCHEMBL31487082 0.81 PDE5A (0.51) IGF1RTGFBR1ALDH1A1USP1WDR48
SCHEMBL18414929 0.79 TGFBR1 (0.57) IGF1RTGFBR1ALDH1A1MAPTUSP1
SCHEMBL25867762 0.78 MAP4K4 (0.55) IGF1RTGFBR1USP1WDR48PDE10A
SCHEMBL13840984 0.74 IGF1R (0.51) IGF1RTGFBR1TGFBR2
SCHEMBL12314363 0.74 IGF1R (0.46) IGF1RTGFBR1TGFBR2
SCHEMBL22899621 0.73 PTPN1 (0.44) IGF1RTGFBR1MAP4K4TGFBR2
SCHEMBL18414643 0.73 TGFBR1 (0.61) IGF1RTGFBR1MAP4K4TGFBR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170218000-A1 PHOSPHOROUS DERIVATIVES AS KINASE INHIBITORS ARIAD PHARMACEUTICALS, INC. 2017-08-03 US disclosed
US-20160376297-A1 Phosphorous Derivatives as Kinase Inhibitors ARIAD PHARMA INC (US) 2016-12-29 US disclosed
US-9273077-B2 Phosphorus derivatives as kinase inhibitors ARIAD PHARMACEUTICALS, INC. (US) 2016-03-01 US disclosed
US-20150225436-A1 PHOSPHOROUS DERIVATIVES AS KINASE INHIBITORS ARIAD PHARMACEUTICALS, INC. (US) 2015-08-13 US disclosed
US-9012462-B2 Phosphorous derivatives as kinase inhibitors ARIAD PHARMACEUTICALS, INC. (US) 2015-04-21 US disclosed
US-20140066406-A1 Phosphorus Derivatives as Kinase Inhibitors ARIAD PHARMACEUTICALS, INC. (US) 2014-03-06 US disclosed
US-20130225527-A1 Phosphorus Derivatives as Kinase Inhibitors ARIAD PHARMACEUTICALS, INC. (US) 2013-08-29 US disclosed
US-20130225528-A1 Phosphorus Derivatives as Kinase Inhibitors ARIAD PHARMACEUTICALS, INC. (US) 2013-08-29 US disclosed
US-20120202776-A1 PHOSPHORUS DERIVATIVES AS KINASE INHIBITORS ARIAD PHARMACEUTICALS, INC. (US) 2012-08-09 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 (7 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-20140066406-A1 Phosphorus Derivatives as Kinase Inhibitors PHKA1, PIK3CA, PHKA2 IGF1R 543/4885TGFBR1 2521/4885ALDH1A1 4707/4885
US-20170218000-A1 PHOSPHOROUS DERIVATIVES AS KINASE INHIBITORS MAP3K6, PIK3CA, MAP3K20 IGF1R 526/4885TGFBR1 2168/4885ALDH1A1 4677/4885
US-20150225436-A1 PHOSPHOROUS DERIVATIVES AS KINASE INHIBITORS MAP3K6, PIK3CA, MAP3K20 IGF1R 586/4885TGFBR1 2351/4885ALDH1A1 4769/4885
US-20120202776-A1 PHOSPHORUS DERIVATIVES AS KINASE INHIBITORS PHKA1, PIK3CA, PHKA2 IGF1R 477/4885TGFBR1 2135/4885ALDH1A1 4596/4885
US-20160376297-A1 Phosphorous Derivatives as Kinase Inhibitors MAP3K6, PIK3CA, MAP3K20 IGF1R 586/4885TGFBR1 2351/4885ALDH1A1 4769/4885
US-20130225527-A1 Phosphorus Derivatives as Kinase Inhibitors PHKA1, PIK3CA, PHKA2 IGF1R 543/4885TGFBR1 2521/4885ALDH1A1 4707/4885
US-20130225528-A1 Phosphorus Derivatives as Kinase Inhibitors PHKA1, PIK3CA, PHKA2 IGF1R 543/4885TGFBR1 2521/4885ALDH1A1 4707/4885

“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.