SCHEMBL8507513

SCHEMBL8507513

CC1(C)SC(c2cccnc2)N(C=O)C1C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ ALDH1A1 P00352 6/20 0.39
▸ KDM4E B2RXH2 3/20 0.39
▸ ALOX15 P16050 2/20 0.37
▸ BLM P54132 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ RIPK1 Q13546 1/20 0.36
▸ TNKS O95271 1/20 0.35
▸ TDP1 Q9NUW8 2/20 0.34
▸ LMNA P02545 1/20 0.34
▸ HPGD P15428 1/20 0.34

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
SCHEMBL11724613 0.77 MEN1 (0.41) MEN1KMT2AALDH1A1KDM4EALOX15
SCHEMBL9740818 0.72 ALDH1A1 (0.52) ALDH1A1KDM4E
SCHEMBL10425283 0.72 ALDH1A1 (0.52) ALDH1A1KDM4E
SCHEMBL8504688 0.68 PTAFR (0.40) ALDH1A1KDM4ERAB9AGAA
SCHEMBL58587 0.67 KMT2A (0.54) MEN1KMT2AKDM4EALOX15CYP1A2
SCHEMBL57526 0.67 KMT2A (0.54) MEN1KMT2AKDM4EALOX15CYP1A2
SCHEMBL10670936 0.67 KDM4E (0.54) ALDH1A1KDM4ERAB9AGAA
SCHEMBL8504663 0.67 KDM4E (0.54) ALDH1A1KDM4ERAB9AGAA
SCHEMBL27671871 0.67 KDM4E (0.54) ALDH1A1KDM4ERAB9AGAA
SCHEMBL9853982 0.67 KDM4E (0.45) MEN1KMT2AALDH1A1KDM4EALOX15

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-0595924-B1 PLATELET ACTIVATING FACTOR ANTAGONISTS ABBOTT LAB (US) 1999-04-14 — — EP disclosed
US-5459152-A 3-(pyridin-3-yl)-7-(indol-3-yl)carbonyl-1H,3H-pyrrolo(1,2-c) thiazole derivatives; asthma ABBOTT LABORATORIES (US) 1995-10-17 — — US disclosed
EP-0595924-A4 PLATELET ACTIVATING FACTOR ANTAGONISTS ABBOTT LAB (US) 1994-08-24 — — EP disclosed
EP-0595924-A1 PLATELET ACTIVATING FACTOR ANTAGONISTS ABBOTT LABORATORIES (US) 1994-05-11 — — EP disclosed
WO-1993001813-A1 PLATELET ACTIVATING FACTOR ANTAGONISTS ABBOTT LABORATORIES (US) 1993-02-04 — — WO disclosed
US-4529728-A 1H,3H-pyrrolo[1,2-c]thiazole derivatives having anti-allergic and anti-inflammatory activity RHONE-POULENC SANTE (FR) 1985-07-16 — — US disclosed
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