SCHEMBL10203343

SCHEMBL10203343

Cc1cc(C(C)(C)C)cnc1N1CCN(N2CCCC2)CC1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ CNR2 P34972 1/20 0.35
▸ TRPV1 Q8NER1 4/20 0.35
▸ LMNA P02545 2/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ DHODH Q02127 2/20 0.35
▸ KDM4E B2RXH2 3/20 0.35
▸ NPC1 O15118 2/20 0.33
▸ PKM P14618 2/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ SCN10A Q9Y5Y9 1/20 0.33
▸ RECQL P46063 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ POLB P06746 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
SCHEMBL13678371 0.90 MEN1 (0.41) MEN1KMT2ACNR2TRPV1LMNA
SCHEMBL19001046 0.83 LMNA (0.41) MEN1KMT2ACNR2TRPV1LMNA
SCHEMBL14376003 0.80 TP53 (0.42) MEN1KMT2ALMNASMN1; SMN2KDM4E
SCHEMBL10203156 0.80 OPRK1 (0.46) —
SCHEMBL13657963 0.79 ALDH1A1 (0.42) MEN1KMT2ALMNAKDM4EALDH1A1
SCHEMBL12125945 0.76 KDM2B (0.43) MEN1KMT2ALMNASMN1; SMN2ALDH1A1
SCHEMBL14349487 0.75 NPC1 (0.39) MEN1KMT2ATRPV1LMNASMN1; SMN2
SCHEMBL14123414 0.73 KMT2A (0.39) MEN1KMT2AKDM4EPKMALDH1A1
SCHEMBL14123275 0.73 KMT2A (0.39) MEN1KMT2AKDM4EPKMALDH1A1
SCHEMBL14123365 0.73 KMT2A (0.39) MEN1KMT2AKDM4EPKMALDH1A1

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
US-8168636-B2 Polycyclic heteroaryl substituted triazoles useful as Axl inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2012-05-01 — — US disclosed
US-8168636-B2 Polycyclic heteroaryl substituted triazoles useful as Axl inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2012-05-01 — — US disclosed
US-20110098274-A1 POLYCYCLIC HETEROARYL SUBSTITUTED TRIAZOLES USEFUL AS AXL INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2011-04-28 — — US disclosed
US-20110098274-A1 POLYCYCLIC HETEROARYL SUBSTITUTED TRIAZOLES USEFUL AS AXL INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2011-04-28 — — 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-20110098274-A1 POLYCYCLIC HETEROARYL SUBSTITUTED TRIAZOLES USEFUL AS AXL INHIBITORS AXL, TYRO3, ERBB3 MEN1 2269/4885KMT2A 1897/4885CNR2 2773/4885

“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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