SCHEMBL5015989

SCHEMBL5015989

Cc1ccc(N)c2cn[nH]c12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.52
HTT P42858 2/20 0.39
PTK2 Q05397 1/20 0.39
ALDH1A1 P00352 3/20 0.38
BRAF P15056 1/20 0.35
EIF2AK3 Q9NZJ5 1/20 0.35
IDO1 P14902 4/20 0.35
TDO2 P48775 1/20 0.35
PDPK1 O15530 1/20 0.35
RET P07949 1/20 0.34
PI4KA P42356 1/20 0.34
XDH P47989 1/20 0.34
LRRK2 Q5S007 1/20 0.34
PI4K2B Q8TCG2 1/20 0.34
PI4K2A Q9BTU6 1/20 0.34
PI4KB Q9UBF8 1/20 0.34
DRD4 P21917 1/20 0.34
LMNA P02545 1/20 0.34
TSHR P16473 1/20 0.34
MAPK10 P53779 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
SCHEMBL15717018 0.84 MAPT (0.52) MAPTHTTPTK2ALDH1A1IDO1
SCHEMBL6127809 0.83 MAPT (0.48) MAPTHTTPTK2ALDH1A1BRAF
SCHEMBL29803170 0.83 MAPT (0.39) MAPTHTTPTK2ALDH1A1IDO1
SCHEMBL4951467 0.83 MAPT (0.39) MAPTHTTPTK2ALDH1A1IDO1
SCHEMBL6066183 0.77 BRAF (0.36) MAPTHTTALDH1A1BRAFEIF2AK3
SCHEMBL18953590 0.76 METAP2 (0.36) MAPTPTK2ALDH1A1BRAFEIF2AK3
SCHEMBL25469229 0.76 MAPT (0.43) MAPTHTTPTK2ALDH1A1BRAF
SCHEMBL17697600 0.76 NOS1 (0.46) MAPTHTTPTK2ALDH1A1BRAF
SCHEMBL15687490 0.76 NOS1 (0.46) MAPTHTTPTK2ALDH1A1BRAF
SCHEMBL3496477 0.76 NOS1 (0.46) MAPTHTTPTK2ALDH1A1BRAF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0904769-B1 Keratin fibre dye compositions containing Indazole amine derivatives and dyeing method OREAL (FR) 2002-09-25 EP claimed
US-20240174647-A1 KINASE MODULATORS AND METHODS OF USE THEREOF NEURON23, INC. 2024-05-30 US disclosed
WO-2024073073-A2 KINASE MODULATORS AND METHODS OF USE THEREOF NEURON23, INC. (US) 2024-04-04 WO disclosed
WO-2017098421-A1 BENZOTHIADIAZINE COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2017-06-15 WO disclosed
EP-1660455-B1 FUSED AZABICYCLIC COMPOUNDS THAT INHIBIT VANILLOID RECEPTOR SUBTYPE 1 (VR1) RECEPTOR ABBOTT LAB (US) 2008-10-15 EP disclosed
US-6933311-B2 Fused azabicyclic compounds that inhibit vanilloid receptor subtype 1 (VR1) receptor ABBOTT LABORATORIES (US) 2005-08-23 US disclosed
US-20050113576-A1 Fused azabicyclic compounds that inhibit vanilloid receptor subtype 1 (VR1) receptor ABBOTT LABORATORIES 2005-05-26 US disclosed
US-20040157849-A1 Fused azabicyclic compounds that inhibit vanilloid receptor subtype 1 (VR1) receptor ABBVIE INC. 2004-08-12 US disclosed
US-6027538-A OXIDATION DYEING OF KERATINOUS FIBERS CONTAINING AT LEAST ONE COUPLER SELECTED FROM INDAZOLEAMINE DERIVATIVES AND AT LEAST ONE OXIDATION BASE; POWERFUL, NOT VERY SELECTIVE HAIR DYES WHICH ARE CAPABLE OF GENERATING INTENSE COLOR L'OREAL S.A. (FR) 2000-02-22 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 (3 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-20040157849-A1 Fused azabicyclic compounds that inhibit vanilloid receptor subtype 1 (VR1) receptor TRPV1, VIPR1, TMEM109 MAPT 4186/4885HTT 4597/4885PTK2 1398/4885
US-20050113576-A1 Fused azabicyclic compounds that inhibit vanilloid receptor subtype 1 (VR1) receptor TRPV1, TMEM109, VIPR1 MAPT 4192/4885HTT 4593/4885PTK2 1271/4885
US-20240174647-A1 KINASE MODULATORS AND METHODS OF USE THEREOF LRRK2, MAP3K20, MAP3K5 MAPT 623/4885HTT 466/4885PTK2 155/4885

“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.