SCHEMBL7406512

SCHEMBL7406512

CCN(CC)C(=O)c1cccc(C(=O)N(CC)CC)c1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 9/20 0.79
▸ TDP1 Q9NUW8 1/20 0.79
▸ ALDH1A1 P00352 5/20 0.63
▸ LMNA P02545 4/20 0.61
▸ TSHR P16473 1/20 0.61
▸ HSP90AA1 P07900 5/20 0.59
▸ HSP90AB1 P08238 5/20 0.59
▸ MAPT P10636 1/20 0.58
▸ SMN1; SMN2 Q16637 2/20 0.58
▸ NPC1 O15118 1/20 0.58
▸ RAB9A P51151 1/20 0.58
▸ CYP1A2 P05177 1/20 0.54
▸ BLM P54132 1/20 0.54
▸ MLYCD O95822 1/20 0.52
▸ MEN1 O00255 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ PPARG P37231 1/20 0.51
▸ OPRM1 P35372 1/20 0.51
▸ OPRD1 P41143 1/20 0.51

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
SCHEMBL2566192 0.92 HPGD (0.69) HPGDTDP1ALDH1A1LMNATSHR
SCHEMBL29386132 0.92 HPGD (0.69) HPGDTDP1ALDH1A1LMNATSHR
SCHEMBL2854780 0.91 HPGD (0.67) HPGDTDP1ALDH1A1LMNATSHR
SCHEMBL16005309 0.91 HPGD (0.67) HPGDTDP1ALDH1A1LMNATSHR
SCHEMBL11506268 0.89 HPGD (0.77) HPGDTDP1ALDH1A1LMNATSHR
Diethyltoluamide SCHEMBL29374310 0.88 HPGD (1.00) HPGDTDP1ALDH1A1LMNATSHR
Diethyltoluamide SCHEMBL29976 0.88 HPGD (1.00) HPGDTDP1ALDH1A1LMNATSHR
SCHEMBL1867393 0.88 HPGD (0.69) HPGDTDP1ALDH1A1LMNATSHR
SCHEMBL4300450 0.88 HPGD (0.69) HPGDTDP1ALDH1A1LMNATSHR
Diethyltoluamide SCHEMBL3797487 0.88 HPGD (1.00) HPGDTDP1ALDH1A1LMNATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0813525-A1 BENZAMIDINE DERIVATIVES THEIR PREPARATION AND THEIR USE AS ANTI-COAGULANTS BERLEX LABORATORIES, INC. (US) 1997-12-29 — — EP disclosed
WO-1996028427-A1 BENZAMIDINE DERIVATIVES THEIR PREPARATION AND THEIR USE AS ANTI-COAGULANTS BERLEX LABORATORIES, INC. (US) 1996-09-19 — — WO disclosed
US-4665410-A THERMOGRAPHY RICOH COMPANY, LTD. (JP) 1987-05-12 — — US disclosed
US-4663641-A LEUCO DYES; DECOLORIZING AGENTS, PIPERAZINE COMPOUND; AMIDES AND TERTIARY AMINES RICOH COMPANY, LTD. (JP) 1987-05-05 — — US disclosed
US-4613878-A DECOLORIZING AGENT COMPRISING AROMATIC DIAMIDE OR PIPERAZINE DERIVATIVE, HAVING TWO ACYLAMINO GROUPS RICOH COMPANY, LTD. (JP) 1986-09-23 — — US disclosed
US-4133833-A TITANIUM CATALYSTS ONE STEP PFIZER INC. (US) 1979-01-09 — — US disclosed
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