SCHEMBL10891764

SCHEMBL10891764

CC(=O)NC1=NN(c2nc3c(s2)CCCC3)C(c2ccccc2)C1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.45
▸ KMT2A Q03164 5/20 0.45
▸ ATM Q13315 3/20 0.45
▸ SLC27A1 Q6PCB7 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.39
▸ ALDH1A1 P00352 8/20 0.39
▸ LMNA P02545 5/20 0.39
▸ NPC1 O15118 4/20 0.39
▸ RAB9A P51151 4/20 0.39
▸ SMN1; SMN2 Q16637 4/20 0.39
▸ POLB P06746 2/20 0.39
▸ ALOX15 P16050 1/20 0.38
▸ MAPT P10636 4/20 0.38
▸ TP53 P04637 3/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ TSHR P16473 1/20 0.37
▸ USP2 O75604 1/20 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
SCHEMBL10890976 0.88 ALDH1A1 (0.43) MEN1KMT2ASLC27A1HSD17B10ALDH1A1
SCHEMBL10891545 0.86 ALDH1A1 (0.36) MEN1KMT2AATMSLC27A1HSD17B10
SCHEMBL10887197 0.85 MEN1 (0.37) MEN1KMT2AATMSLC27A1ALDH1A1
SCHEMBL10892079 0.83 SLC27A1 (0.35) MEN1KMT2AATMSLC27A1ALDH1A1
SCHEMBL11185641 0.80 MAPT (0.47) MEN1KMT2AATMHSD17B10ALDH1A1
SCHEMBL10894037 0.80 MAPT (0.35) SLC27A1ALDH1A1LMNANPC1RAB9A
SCHEMBL10890556 0.78 MAPT (0.40) MEN1KMT2AATMSLC27A1HSD17B10
SCHEMBL10893914 0.72 ABL1 (0.44) MEN1KMT2ASLC27A1HSD17B10ALDH1A1
Hydrochloric Acid SCHEMBL10889776 0.71 ABL1 (0.43) MEN1KMT2ASLC27A1HSD17B10ALDH1A1
SCHEMBL10891246 0.70 GAA (0.40) MEN1KMT2ASLC27A1HSD17B10ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4600722-A 3-amino-1-(4,5,6,7-tetrahydro-benzothiazolyl)-2-pyrazolines and a process for the treatment of inflammatory or allergic processes in humans A. NATTERMANN & CIE GMBH (DE) 1986-07-15 — — US disclosed
EP-0155523-A1 3-Amino-1-(4,5,6,7-Tetrahydro-benzothiazolyl)-2-Pyrazolines,a process for their preparation and pharmaceutical products containing these compounds A. Nattermann & Cie. GmbH (DE) 1985-09-25 — — EP disclosed
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