SCHEMBL9494018

SCHEMBL9494018

C=C(C)CN1C(=O)C(C)S/C1=N/N=C1/SC(O)C(=O)N1C

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ NPC1 O15118 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ PKM P14618 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ RECQL P46063 1/20 0.32
▸ MCL1 Q07820 1/20 0.32
▸ BLM P54132 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ RAB9A P51151 1/20 0.30

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
SCHEMBL9494024 1.00 ALDH1A1 (0.33) ALDH1A1MEN1KMT2ANPC1KDM4E
SCHEMBL9494748 0.82 — —
SCHEMBL9494743 0.82 — —
SCHEMBL10880739 0.82 ALDH1A1 (0.49) ALDH1A1MEN1KMT2ANPC1KDM4E
SCHEMBL10880745 0.82 ALDH1A1 (0.49) ALDH1A1MEN1KMT2ANPC1KDM4E
SCHEMBL10726048 0.81 ALDH1A1 (0.33) ALDH1A1MEN1KMT2ANPC1KDM4E
SCHEMBL10876986 0.80 ALDH1A1 (0.33) ALDH1A1L3MBTL1RECQLMCL1
SCHEMBL9493724 0.80 ALDH1A1 (0.31) ALDH1A1L3MBTL1RECQLMCL1
SCHEMBL9492364 0.80 ALDH1A1 (0.39) ALDH1A1MEN1KMT2AKDM4E
SCHEMBL9492368 0.80 ALDH1A1 (0.39) ALDH1A1MEN1KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0494047-A1 Use of carbazones for the treatment of rheumatoid diseases CIBA-GEIGY AG (CH) 1992-07-08 — — EP claimed
US-5177091-A Rheumatic disorders CIBA-GEIGY CORPORATION (US) 1993-01-05 — — US disclosed
EP-0494047-A1 Use of carbazones for the treatment of rheumatoid diseases CIBA-GEIGY AG (CH) 1992-07-08 — — EP disclosed
EP-0224515-A1 SUBSTITUTED THIAZOLIDINYL ETHER CIBA-GEIGY AG (CH) 1987-06-10 — — EP disclosed
WO-1986007360-A1 SUBSTITUTED THIAZOLIDINYL ETHER CIBA-GEIGY AG (CH) 1986-12-18 — — WO disclosed
US-4582841-A ANTITUMOR AND -CARCINOGENIC AGENTS CIBA-GEIGY CORPORATION (US) 1986-04-15 — — US disclosed
EP-0085275-B1 SUBSTITUTED THIAZOLIDINYLIC ESTERS OF MINERAL ACIDS CIBA-GEIGY AG (CH) 1986-02-19 — — EP disclosed
EP-0085275-A1 Substituted thiazolidinylic esters of mineral acids CIBA-GEIGY AG (CH) 1983-08-10 — — EP disclosed
Send feedback