SCHEMBL6096934

SCHEMBL6096934

Nc1ccc(O)cc1C(=O)C=CN1CCCC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.42
CTSB P07858 1/20 0.42
MAPT P10636 7/20 0.42
ALDH1A1 P00352 4/20 0.42
NPC1 O15118 3/20 0.42
MAPK1 P28482 3/20 0.42
USP2 O75604 2/20 0.42
LMNA P02545 2/20 0.42
IP6K1 Q92551 1/20 0.41
GUSB P08236 2/20 0.40
CHRNA7 P36544 7/20 0.39
HPGD P15428 4/20 0.37
ALOX15 P16050 4/20 0.37
HSD17B10 Q99714 4/20 0.37
TP53 P04637 3/20 0.37
RAB9A P51151 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
IDO1 P14902 1/20 0.37
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37

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
SCHEMBL6096641 0.89 NPC1 (0.51) CTSLCTSBMAPTALDH1A1NPC1
SCHEMBL6097293 0.89 APP (0.38) MAPTALDH1A1NPC1MAPK1USP2
SCHEMBL6096739 0.88 GUSB (0.36) CTSLCTSBMAPTALDH1A1NPC1
SCHEMBL6139109 0.86 MAPT (0.49) MAPTALDH1A1NPC1MAPK1USP2
Hydrochloric Acid SCHEMBL6139145 0.85 MAPT (0.49) MAPTALDH1A1NPC1MAPK1USP2
SCHEMBL6096099 0.84 SMARCA2 (0.36) CTSLCTSBMAPTALDH1A1LMNA
SCHEMBL6095314 0.77 MEN1 (0.36) CTSLCTSBMAPTALDH1A1MAPK1
SCHEMBL6094562 0.76 KDM4E (0.49) MAPTALDH1A1NPC1MAPK1USP2
SCHEMBL6138943 0.75 MAPT (0.52) MAPTALDH1A1NPC1MAPK1USP2
Hydrochloric Acid SCHEMBL6095852 0.75 MEN1 (0.47) MAPTALDH1A1NPC1MAPK1USP2

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-7070626-B2 (P-amino-hydroxyphenyl)-acrylamide derivatives and dyes containing said compounds WELLA AG (DE) 2006-07-04 US disclosed
EP-1286953-B1 (P-AMINO-HYDROXYPHENYL)-ACRYLAMIDE DERIVATIVES AND DYES CONTAINING SAID COMPOUNDS WELLA AG (DE) 2004-02-18 EP disclosed
US-20030192132-A1 (P-amino-hydroxyphenyl)-acrylamide derivatives and dyes containing said compounds HFC PRESTIGE INTERNATIONAL HOLDING SWITZERLAND S.A.R.L (CH) 2003-10-16 US disclosed
EP-1286953-A1 (P-AMINO-HYDROXYPHENYL)-ACRYLAMIDE DERIVATIVES AND DYES CONTAINING SAID COMPOUNDS Wella Aktiengesellschaft (DE) 2003-03-05 EP disclosed
WO-2002079144-A1 (P-AMINO-HYDROXYPHENYL)-ACRYLAMIDE DERIVATIVES AND DYES CONTAINING SAID COMPOUNDS WELLA AKTIENGESELLSCHAFT (DE) 2002-10-10 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-20030192132-A1 (P-amino-hydroxyphenyl)-acrylamide derivatives and dyes containing said compounds KRT18, ALDH7A1, IK CTSL 3715/4885CTSB 4633/4885MAPT 666/4885

“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.