SCHEMBL15613577

SCHEMBL15613577

Cc1ncc(COc2cc(O)cc(F)c2)cn1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CYP4F2 P78329 1/20 0.40
▸ CYP4A11 Q02928 1/20 0.40
▸ CA12 O43570 1/20 0.38
▸ CA1 P00915 1/20 0.38
▸ CA9 Q16790 1/20 0.38
▸ BTK Q06187 2/20 0.37
▸ MAOB P27338 4/20 0.35
▸ MAOA P21397 1/20 0.35
▸ HDAC1 Q13547 1/20 0.35
▸ HDAC6 Q9UBN7 1/20 0.35
▸ HDAC5 Q9UQL6 1/20 0.35
▸ CGAS Q8N884 1/20 0.35
▸ ALKBH1 Q13686 1/20 0.34
▸ SOD1 P00441 1/20 0.34
▸ CYP1A1 P04798 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP19A1 P11511 1/20 0.34
▸ MRGPRX4 Q96LA9 1/20 0.33

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
SCHEMBL15613633 0.83 CYP4F2 (0.41) CYP4F2CYP4A11MAOBMAOACYP1A1
SCHEMBL15615099 0.83 MAOB (0.42) BTKMAOBHDAC1HDAC6HDAC5
SCHEMBL15613737 0.82 CYP4F2 (0.41) CYP4F2CYP4A11CA12CA1CA9
SCHEMBL15613576 0.80 HDAC1 (0.36) CA12CA1CA9BTKMAOB
SCHEMBL21944603 0.76 MAOB (0.53) MAOBMAOA
SCHEMBL16748844 0.76 BTK (0.47) BTKMAOBMAOACYP1A2
SCHEMBL28994206 0.75 NR4A2 (0.51) BTKMRGPRX4
SCHEMBL30289685 0.75 NR4A2 (0.51) BTKMRGPRX4
SCHEMBL16886123 0.75 CYP1A2 (0.58) CYP4F2CYP4A11MAOBHDAC6CYP1A1
SCHEMBL31183087 0.75 CYP1A2 (0.58) CYP4F2CYP4A11MAOBHDAC6CYP1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9796716-B2 Selective inhibitors of Tec and Src protein kinase families PHARMASCIENCE, INC. (CA) 2017-10-24 — — US disclosed
US-9796716-B2 Selective inhibitors of Tec and Src protein kinase families PHARMASCIENCE, INC. (CA) 2017-10-24 — — US disclosed
US-20150191473-A1 PROTEIN KINASE INHIBITORS PHARMASCIENCE, INC. (CA) 2015-07-09 — — US disclosed
US-20150191473-A1 PROTEIN KINASE INHIBITORS PHARMASCIENCE, INC. (CA) 2015-07-09 — — US disclosed
WO-2013177668-A1 PROTEIN KINASE INHIBITORS PHARMASCIENCE, INC. (CA) 2013-12-05 — — WO 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-20150191473-A1 PROTEIN KINASE INHIBITORS TEC, SRC, LCK CYP4F2 3996/4885CYP4A11 4527/4885CA12 4667/4885

“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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