SCHEMBL11263001

SCHEMBL11263001

Cc1ccc(C2SCC(C(=O)O)N2C[C@H](C)C(=O)SSC(=O)[C@@H](C)CN2C(C(=O)O)CSC2c2ccc(C)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 3/20 0.40
▸ GAA P10253 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.34
▸ MEN1 O00255 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ FFAR2 O15552 3/20 0.33
▸ ALDH1A1 P00352 3/20 0.33
▸ HPGD P15428 1/20 0.33
▸ ACE P12821 1/20 0.32

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
SCHEMBL11183987 0.88 GAA (0.57) POLBGAARAB9AMEN1KMT2A
SCHEMBL11202283 0.88 POLB (0.38) POLBGAARAB9AKDM4EMAPT
SCHEMBL11184581 0.87 POLB (0.40) POLBGAARAB9AMAPTHSD17B10
SCHEMBL11189268 0.81 ALDH1A1 (0.44) POLBKDM4EMAPTALDH1A1
SCHEMBL11201178 0.81 GAA (0.42) POLBGAARAB9AKDM4EFFAR2
SCHEMBL11194045 0.80 ACE (0.51) POLBKMT2AFFAR2ALDH1A1HPGD
SCHEMBL11199610 0.79 TUBB4A (0.38) POLBGAARAB9AMAPTKMT2A
SCHEMBL11190617 0.79 FFAR2 (0.44) POLBGAARAB9AKDM4EMAPT
SCHEMBL11199916 0.78 SMN1; SMN2 (0.44) POLBGAARAB9AKDM4EMAPT
SCHEMBL11219804 0.76 ACE (0.36) POLBMEN1KMT2AFFAR2ALDH1A1

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-4347371-A HYPERTENSIVE AGENTS; ANTIDIABETIC AGENTS; VISION DEFECTS SANTEN PHARMACEUTICAL CO., LTD. (JP) 1982-08-31 — — US claimed
US-4347371-A HYPERTENSIVE AGENTS; ANTIDIABETIC AGENTS; VISION DEFECTS SANTEN PHARMACEUTICAL CO., LTD. (JP) 1982-08-31 — — US disclosed
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