SCHEMBL15219308

SCHEMBL15219308

Cc1cnc(CN2CCNCC2)o1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ SOS1 Q07889 1/20 0.43
▸ LMNA P02545 1/20 0.41
▸ SIGMAR1 Q99720 1/20 0.40
▸ CXCR4 P61073 7/20 0.39
▸ ALDH1A1 P00352 1/20 0.38
▸ MEN1 O00255 1/20 0.37
▸ CHRM2 P08172 1/20 0.37
▸ CHRM1 P11229 1/20 0.37
▸ ADRA2C P18825 1/20 0.37
▸ CCR2 P41597 1/20 0.37
▸ CXCL12 P48061 1/20 0.37
▸ BLM P54132 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ HRH3 Q9Y5N1 1/20 0.37
▸ HTR2C P28335 1/20 0.36
▸ KDM5C P41229 1/20 0.35
▸ KDM4C Q9H3R0 1/20 0.35

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
SCHEMBL11919161 0.81 SOS1 (0.41) SOS1LMNASIGMAR1CXCR4ALDH1A1
SCHEMBL11915977 0.81 CDK9 (0.45) SOS1LMNASIGMAR1CXCR4ALDH1A1
SCHEMBL13294390 0.80 SOS1 (0.43) SOS1LMNASIGMAR1CXCR4ALDH1A1
SCHEMBL11552590 0.74 NOTUM (0.53) SOS1LMNASIGMAR1ALDH1A1KMT2A
SCHEMBL11622040 0.74 SMN1; SMN2 (0.56) LMNAALDH1A1KMT2A
SCHEMBL16026584 0.71 SOS1 (0.47) SOS1LMNASIGMAR1CXCR4ALDH1A1
SCHEMBL15219267 0.70 CXCR4 (0.45) LMNASIGMAR1CXCR4ALDH1A1MEN1
SCHEMBL14606249 0.70 SIGMAR1 (0.52) LMNASIGMAR1CXCR4MEN1CHRM2
SCHEMBL16400073 0.70 HRH3 (0.42) TDP1HRH3HTR2C
SCHEMBL9071079 0.70 ALDH1A1 (0.49) LMNASIGMAR1ALDH1A1MEN1KMT2A

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 12 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-9012462-B2 Phosphorous derivatives as kinase inhibitors ARIAD PHARMACEUTICALS, INC. (US) 2015-04-21 — — US disclosed
US-8912330-B2 Azaindole derivatives as kinase inhibitors ARIAD PHARMACEUTICALS, INC. (US) 2014-12-16 — — US disclosed
US-20140364423-A1 Pyrazinopyrazines and Derivatives as Kinase Inhibitors ARIAD PHARMACEUTICALS, INC. 2014-12-11 — — US disclosed
US-8846664-B2 Pyrazinopyrazines and derivatives as kinase inhibitors ARIAD PHARMACEUTICALS, INC. (US) 2014-09-30 — — 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-20110294806-A1 AZAINDOLE DERIVATIVES AS KINASE INHIBITORS ARIAD PHARMACEUTICALS, INC. (US) 2011-12-01 — — 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 SOS1 1969/4885LMNA 3954/4885SIGMAR1 3464/4885
US-20170218000-A1 PHOSPHOROUS DERIVATIVES AS KINASE INHIBITORS MAP3K6, PIK3CA, MAP3K20 SOS1 1087/4885LMNA 4121/4885SIGMAR1 3576/4885
US-20150225436-A1 PHOSPHOROUS DERIVATIVES AS KINASE INHIBITORS MAP3K6, PIK3CA, MAP3K20 SOS1 1165/4885LMNA 4289/4885SIGMAR1 3899/4885
US-20140364423-A1 Pyrazinopyrazines and Derivatives as Kinase Inhibitors MAP3K5, MAP3K15, MAP4K2 SOS1 2789/4885LMNA 4181/4885SIGMAR1 3181/4885
US-20110294806-A1 AZAINDOLE DERIVATIVES AS KINASE INHIBITORS ABL1, CDKN1A, MAP3K13 SOS1 2668/4885LMNA 4433/4885SIGMAR1 3057/4885
US-20130225527-A1 Phosphorus Derivatives as Kinase Inhibitors PHKA1, PIK3CA, PHKA2 SOS1 1969/4885LMNA 3954/4885SIGMAR1 3464/4885
US-20130225528-A1 Phosphorus Derivatives as Kinase Inhibitors PHKA1, PIK3CA, PHKA2 SOS1 1969/4885LMNA 3954/4885SIGMAR1 3464/4885

“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.

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