SCHEMBL19008155

SCHEMBL19008155

CC(C)c1cc(F)cc(CNC2CN(C)C2)c1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MAP4K4 O95819 3/20 0.46
▸ CARM1 Q86X55 7/20 0.43
▸ PRMT6 Q96LA8 7/20 0.43
▸ OPRL1 P41146 1/20 0.32
▸ KCNH2 Q12809 1/20 0.32
▸ CCNT1 O60563 1/20 0.32
▸ CDK9 P50750 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ POLB P06746 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
SCHEMBL15587409 0.86 MAP4K4 (0.47) MAP4K4CARM1PRMT6OPRL1
SCHEMBL19016213 0.85 ALDH1A1 (0.41) MAP4K4CARM1PRMT6OPRL1KCNH2
SCHEMBL19008146 0.82 MAP4K4 (0.44) MAP4K4CARM1PRMT6ALDH1A1
SCHEMBL19008167 0.82 ALDH1A1 (0.45) MAP4K4CARM1PRMT6KCNH2KDM4E
SCHEMBL18626597 0.82 ALDH1A1 (0.49) MAP4K4KCNH2KDM4EALDH1A1POLB
SCHEMBL15587406 0.81 MAP4K4 (0.48) MAP4K4CARM1PRMT6OPRL1KDM4E
SCHEMBL18626535 0.80 TSHR (0.43) MAP4K4CARM1PRMT6OPRL1KCNH2
SCHEMBL19008163 0.79 LMNA (0.37) MAP4K4CARM1PRMT6KCNH2KDM4E
SCHEMBL18626596 0.79 MAP4K4 (0.45) MAP4K4CARM1PRMT6OPRL1ALDH1A1
SCHEMBL19008166 0.78 BACE1 (0.47) MAP4K4CARM1PRMT6ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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 662/4885CARM1 2613/4885PRMT6 128/4885

“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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