SCHEMBL16491460

SCHEMBL16491460

CCCCCCN(CCN(C)C)c1ccc2ccccc2n1

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PTK2 Q05397 1/20 0.56
▸ NCF1 P14598 1/20 0.50
▸ ELANE P08246 2/20 0.40
▸ DNM1 Q05193 3/20 0.39
▸ GPBAR1 Q8TDU6 1/20 0.39
▸ TLR8 Q9NR97 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ CXCR3 P49682 2/20 0.37
▸ PPARG P37231 1/20 0.37
▸ PPARD Q03181 1/20 0.37
▸ PPARA Q07869 1/20 0.37
▸ CYP1A2 P05177 1/20 0.36
▸ HIF1A Q16665 1/20 0.36

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
SCHEMBL16491462 1.00 PTK2 (0.56) PTK2NCF1ELANEDNM1GPBAR1
SCHEMBL16491459 1.00 PTK2 (0.56) PTK2NCF1ELANEDNM1GPBAR1
SCHEMBL16491457 1.00 PTK2 (0.56) PTK2NCF1ELANEDNM1GPBAR1
SCHEMBL25488411 0.86 NCF1 (0.56) PTK2NCF1ELANEGPBAR1TLR8
SCHEMBL13701721 0.80 NCF1 (0.60) PTK2NCF1ELANEGPBAR1MEN1
SCHEMBL16491446 0.77 CHRM2 (0.60) PTK2DNM1MEN1KMT2ACYP1A2
SCHEMBL16491470 0.77 CHRM2 (0.60) PTK2DNM1MEN1KMT2ACYP1A2
SCHEMBL16491448 0.77 CHRM2 (0.60) PTK2DNM1MEN1KMT2ACYP1A2
SCHEMBL16491456 0.77 CHRM2 (0.60) PTK2DNM1MEN1KMT2ACYP1A2
SCHEMBL16491466 0.77 CHRM2 (0.60) PTK2DNM1MEN1KMT2ACYP1A2

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-9394253-B2 Kinase protein binding inhibitors HEALTH RESEARCH, INC. (US) 2016-07-19 — — US disclosed
US-20150051245-A1 KINASE PROTEIN BINDING INHIBITORS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-02-19 — — 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-20150051245-A1 KINASE PROTEIN BINDING INHIBITORS PACSIN2, PRKCH, CKS1B PTK2 84/4885NCF1 783/4885ELANE 3851/4885

“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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