SCHEMBL19226473

SCHEMBL19226473

Cc1cccc(C(C)NC(C)C)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAP4K4 O95819 1/20 0.43
▸ HTT P42858 1/20 0.42
▸ RECQL P46063 1/20 0.42
▸ CCR1 P32246 1/20 0.41
▸ CCR8 P51685 1/20 0.41
▸ NOS3 P29474 1/20 0.39
▸ NOS2 P35228 1/20 0.39
▸ LTC4S Q16873 1/20 0.37
▸ RAB9A P51151 2/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ IRAK4 Q9NWZ3 1/20 0.36
▸ FDPS P14324 1/20 0.35
▸ FDFT1 P37268 1/20 0.35
▸ P2RX7 Q99572 1/20 0.34
▸ PARP1 P09874 1/20 0.34
▸ GRM5 P41594 4/20 0.33
▸ NR4A2 P43354 1/20 0.32
▸ ALDH1A1 P00352 3/20 0.32
▸ KDM4E B2RXH2 2/20 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
SCHEMBL16130221 0.92 MAP4K4 (0.46) MAP4K4HTTRECQLCCR1CCR8
SCHEMBL9447422 0.82 IRAK4 (0.48) MAP4K4HTTRECQLCCR1CCR8
SCHEMBL15587862 0.80 MAP4K4 (0.43) MAP4K4HTTRECQLCCR1CCR8
SCHEMBL17886900 0.77 MAP4K4 (0.45) MAP4K4HTTRECQLCCR1CCR8
SCHEMBL102150 0.76 CCR1 (0.50) MAP4K4HTTRECQLCCR1CCR8
SCHEMBL18793746 0.74 MAP4K4 (0.38) MAP4K4HTTRECQLCCR1CCR8
SCHEMBL23666724 0.74 RAB9A (0.43) MAP4K4HTTRECQLRAB9AFDPS
SCHEMBL15890717 0.74 MAP4K4 (0.46) MAP4K4HTTRECQLCCR1CCR8
SCHEMBL954513 0.73 CCR1 (0.52) MAP4K4HTTRECQLCCR1CCR8
SCHEMBL24375835 0.72 CCR1 (0.46) MAP4K4HTTRECQLCCR1CCR8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190233441-A1 TRIAZOLOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2019-08-01 — — US disclosed
US-9873709-B2 Triazolopyridine compounds, compositions and methods of use thereof GENENTECH, INC. (US) 2018-01-23 — — US disclosed
US-20170226132-A1 TRIAZOLOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2017-08-10 — — 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 (2 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-20190233441-A1 TRIAZOLOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF ABL1, JAK2, JAK1 MAP4K4 27/4885HTT 4749/4885RECQL 2258/4885
US-20170226132-A1 TRIAZOLOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF ABL1, JAK2, JAK1 MAP4K4 27/4885HTT 4749/4885RECQL 2258/4885

“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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