SCHEMBL15219288

SCHEMBL15219288

Cc1ccc(OC2CCN(C3CC3)CC2)c(C)c1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 4/20 0.50
CCR3 P51677 4/20 0.50
HRH3 Q9Y5N1 8/20 0.43
IRAK4 Q9NWZ3 1/20 0.43
SYK P43405 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
HTR2C P28335 1/20 0.39
HTR2B P41595 1/20 0.39
CHRM2 P08172 1/20 0.37
CHRM4 P08173 1/20 0.37
CHRM5 P08912 1/20 0.37
CHRM1 P11229 1/20 0.37
CHRM3 P20309 1/20 0.37
KCNH2 Q12809 1/20 0.37

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
SCHEMBL5544941 0.84 HTR2C (0.49) HRH1CCR3HRH3SYKSMN1; SMN2
SCHEMBL11916167 0.84 KDM4E (0.44) HRH1CCR3HRH3SMN1; SMN2KCNH2
SCHEMBL5544938 0.83 SYK (0.41) HRH1CCR3HRH3SYKSMN1; SMN2
SCHEMBL12146655 0.82 HRH1 (0.42) HRH1CCR3HRH3IRAK4SMN1; SMN2
SCHEMBL11919053 0.79 HRH1 (0.40) HRH1CCR3HRH3KCNH2
SCHEMBL24044010 0.78 KDM4E (0.46) SYKSMN1; SMN2
SCHEMBL4034197 0.76 HRH1 (0.54) HRH1CCR3HTR2CHTR2B
SCHEMBL171093 0.76 HTR2C (0.47) HRH1SYKHTR2CHTR2B
SCHEMBL31203046 0.75 HRH3 (0.39) HRH1CCR3HRH3SYK
SCHEMBL3439664 0.73 SYK (0.41) SYKSMN1; SMN2HTR2CHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3210609-A1 PHOSPHOROUS DERIVATIVES AS KINASE INHIBITORS ARIAD PHARMACEUTICALS, INC. (US) 2017-08-30 EP disclosed
US-20170218000-A1 PHOSPHOROUS DERIVATIVES AS KINASE INHIBITORS ARIAD PHARMACEUTICALS, INC. 2017-08-03 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-20140364423-A1 Pyrazinopyrazines and Derivatives as Kinase Inhibitors ARIAD PHARMACEUTICALS, INC. 2014-12-11 US disclosed
US-20140066406-A1 Phosphorus Derivatives as Kinase Inhibitors ARIAD PHARMACEUTICALS, INC. (US) 2014-03-06 US disclosed
US-20130225528-A1 Phosphorus Derivatives as Kinase Inhibitors ARIAD PHARMACEUTICALS, INC. (US) 2013-08-29 US disclosed
US-20130225527-A1 Phosphorus Derivatives as Kinase Inhibitors ARIAD PHARMACEUTICALS, INC. (US) 2013-08-29 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 (6 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 HRH1 4420/4885CCR3 4798/4885HRH3 3558/4885
US-20170218000-A1 PHOSPHOROUS DERIVATIVES AS KINASE INHIBITORS MAP3K6, PIK3CA, MAP3K20 HRH1 3695/4885CCR3 4696/4885HRH3 2897/4885
US-20150225436-A1 PHOSPHOROUS DERIVATIVES AS KINASE INHIBITORS MAP3K6, PIK3CA, MAP3K20 HRH1 4006/4885CCR3 4641/4885HRH3 2936/4885
US-20140364423-A1 Pyrazinopyrazines and Derivatives as Kinase Inhibitors MAP3K5, MAP3K15, MAP4K2 HRH1 2723/4885CCR3 4550/4885HRH3 3509/4885
US-20130225527-A1 Phosphorus Derivatives as Kinase Inhibitors PHKA1, PIK3CA, PHKA2 HRH1 4420/4885CCR3 4798/4885HRH3 3558/4885
US-20130225528-A1 Phosphorus Derivatives as Kinase Inhibitors PHKA1, PIK3CA, PHKA2 HRH1 4420/4885CCR3 4798/4885HRH3 3558/4885

“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.