SCHEMBL6693671

SCHEMBL6693671

CCOc1cccc2c1N(C1CCCCC1)C(S[N])S2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ RAD52 P43351 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ ALOX12 P18054 1/20 0.33
▸ TSHR P16473 1/20 0.32
▸ HCN1 O60741 1/20 0.32
▸ HCN4 Q9Y3Q4 1/20 0.32
▸ USP2 O75604 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ PDE5A O76074 2/20 0.31
▸ PDE1A P54750 2/20 0.31

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
SCHEMBL6692267 0.91 LMNA (0.35) HRH3ALDH1A1KDM4EMEN1KMT2A
SCHEMBL6689067 0.88 HRH3 (0.35) HRH3ALDH1A1KDM4EMEN1KMT2A
SCHEMBL6698686 0.87 ABCB1 (0.40) KMT2AMAPTLMNAHTR2CABCB1
SCHEMBL6693809 0.81 HRH3 (0.38) HRH3ALDH1A1KDM4EMEN1KMT2A
SCHEMBL6688607 0.80 ALDH1A1 (0.35) HRH3ALDH1A1KDM4EMEN1KMT2A
SCHEMBL6690893 0.78 MAPT (0.33) ALDH1A1KDM4EMEN1KMT2AMAPT
SCHEMBL6693776 0.77 SMN1; SMN2 (0.38) ALDH1A1KDM4EMEN1KMT2AMAPT
SCHEMBL6693175 0.76 MAPT (0.32) ALDH1A1MAPTHTT
SCHEMBL6691800 0.75 ABCB1 (0.40) KMT2AMAPTLMNAHTR2CABCB1
SCHEMBL6692038 0.74 SMN1; SMN2 (0.38) ALDH1A1KDM4EMEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0869016-B1 Pneumatic radial tires BRIDGESTONE CORP (JP) 2004-03-03 — — EP disclosed
EP-0854168-B1 Rubber composition BRIDGESTONE CORP (JP) 2003-04-02 — — EP disclosed
US-6336486-B1 Pneumatic radical tire having cap base tread BRIDGESTONE CORPORATION (JP) 2002-01-08 — — US disclosed
EP-0948029-A2 High pressure discharge lamp NGK INSULATORS, LTD. (JP) 1999-10-06 — — EP disclosed
EP-0869016-A2 Pneumatic radial tires Bridgestone Corporation (JP) 1998-10-07 — — EP disclosed
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