SCHEMBL19008154

SCHEMBL19008154

CC(C)c1cc(F)cc(CNCCN(C)C)c1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAP4K4 O95819 1/20 0.44
▸ CCR2 P41597 4/20 0.36
▸ TACR1 P25103 1/20 0.36
▸ TERT O14746 1/20 0.35
▸ CTSD P07339 1/20 0.35
▸ BACE1 P56817 1/20 0.35
▸ TAAR1 Q96RJ0 2/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ FLT3 P36888 1/20 0.34
▸ SIGMAR1 Q99720 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ NOS2 P35228 1/20 0.33
▸ HPGD P15428 1/20 0.32
▸ MAPK1 P28482 1/20 0.32

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
SCHEMBL17563740 0.84 CTSD (0.36) MAP4K4CTSDBACE1TAAR1L3MBTL1
SCHEMBL18626561 0.81 GSR (0.44) CTSDBACE1L3MBTL1SMN1; SMN2MAPK1
SCHEMBL17896883 0.80 MAP4K4 (0.46) MAP4K4CCR2TACR1TERTTAAR1
SCHEMBL15587594 0.80 MAP4K4 (0.46) MAP4K4CCR2TACR1TERTTAAR1
SCHEMBL18626594 0.78 MAP4K4 (0.43) MAP4K4CTSDBACE1L3MBTL1SMN1; SMN2
SCHEMBL19732441 0.77 TERT (0.46) MAP4K4TERTCTSDBACE1L3MBTL1
SCHEMBL17568875 0.76 NOS1 (0.47) TAAR1FLT3SIGMAR1SMN1; SMN2NOS2
SCHEMBL17562434 0.76 NOS2 (0.43) MAP4K4FLT3NOS2HPGD
SCHEMBL18626552 0.75 CTSD (0.40) CTSDBACE1
SCHEMBL18626562 0.74 MAP4K4 (0.41) MAP4K4CTSDBACE1

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
EP-2855459-B1 AMINOQUINAZOLINE AND PYRIDOPYRIMIDINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2020-04-29 — — EP disclosed
US-9855269-B2 Aminoquinazoline and pyridopyrimidine derivatives GENENTECH, INC. (US) 2018-01-02 — — US disclosed
US-20170173026-A1 AMINOQUINAZOLINE AND PYRIDOPYRIMIDINE DERIVATIVES GENENTECH, INC. (US) 2017-06-22 — — US disclosed
US-20170173026-A1 AMINOQUINAZOLINE AND PYRIDOPYRIMIDINE DERIVATIVES GENENTECH, INC. (US) 2017-06-22 — — 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-20170173026-A1 AMINOQUINAZOLINE AND PYRIDOPYRIMIDINE DERIVATIVES FLT4, FLT1, KDR MAP4K4 662/4885CCR2 63/4885TACR1 2433/4885

“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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