SCHEMBL2070193

SCHEMBL2070193

CCCC(=O)Nc1ccc(N)cc1OC

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.56
ALDH1A1 P00352 3/20 0.54
MAPT P10636 4/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
GAA P10253 1/20 0.53
MTNR1B P49286 1/20 0.52
LMNA P02545 1/20 0.52
NPC1 O15118 3/20 0.52
RAB9A P51151 3/20 0.52
HPGD P15428 1/20 0.51
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
RXFP1 Q9HBX9 1/20 0.50

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
SCHEMBL11353314 0.80 RAD52 (0.59) HTTALDH1A1MAPTSMN1; SMN2GAA
SCHEMBL11001118 0.80 HTT (0.50) HTTALDH1A1GAALMNANPC1
SCHEMBL2070769 0.80 ALDH1A1 (0.52) HTTALDH1A1MAPTSMN1; SMN2GAA
SCHEMBL6353701 0.80 MAPT (0.59) HTTALDH1A1MAPTSMN1; SMN2GAA
SCHEMBL2071884 0.80 GAA (0.59) HTTALDH1A1MAPTSMN1; SMN2GAA
SCHEMBL16592515 0.80 GAA (0.59) HTTALDH1A1MAPTSMN1; SMN2GAA
SCHEMBL2071192 0.79 CYP1A2 (0.56) HTTALDH1A1MAPTSMN1; SMN2GAA
SCHEMBL28577453 0.79 MEN1 (0.74) ALDH1A1GAALMNANPC1RAB9A
SCHEMBL30738420 0.78 ALDH1A1 (0.72) HTTALDH1A1MAPTSMN1; SMN2GAA
SCHEMBL5183678 0.78 ALDH1A1 (0.72) HTTALDH1A1MAPTSMN1; SMN2GAA

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-7906537-B2 Substituted p-diaminobenzene derivatives H. LUNDBECK A/S (DK) 2011-03-15 US disclosed
US-20060183791-A1 Substituted p-diaminobenzene derivatives H. LUNDBECK A/S (DK) 2006-08-17 US disclosed
US-20060110743-A1 Drug evolution: drug design at hot spots KONISHI YASUO 2006-05-25 US disclosed
CN-1761464-A Substituted p-diaminobenzene derivatives LUNDBECK & CO AS H (DK) 2006-04-19 CN disclosed
WO-2002095393-A2 DRUG EVOLUTION: DRUG DESIGN AT HOT SPOTS NATIONAL RESEARCH COUNCIL OF CANADA (CA) 2002-11-28 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-20060183791-A1 Substituted p-diaminobenzene derivatives ABCB1, UGT2B7, CYP2D6 HTT 3204/4885ALDH1A1 112/4885MAPT 3488/4885

“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.