SCHEMBL11836485

SCHEMBL11836485

Cc1ccc(-c2cc3ccc(NN)cc3oc2=O)cc1

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MIF P14174 1/20 0.64
▸ MAOB P27338 13/20 0.62
▸ ADORA3 P0DMS8 2/20 0.62
▸ PON1 P27169 1/20 0.62
▸ MAOA P21397 2/20 0.57
▸ ESR2 Q92731 1/20 0.51
▸ STS P08842 2/20 0.49
▸ ACHE P22303 1/20 0.49

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
SCHEMBL11748471 0.86 MIF (0.64) MIFMAOBADORA3PON1ESR2
SCHEMBL11823066 0.86 MIF (0.64) MIFMAOBADORA3PON1ESR2
SCHEMBL11464166 0.86 NPC1 (0.62) MIFMAOBESR2STS
SCHEMBL11756710 0.85 NPC1 (0.67) MIFMAOBMAOASTSACHE
Hydrochloric Acid SCHEMBL11825435 0.84 NPC1 (0.61) MIFMAOBESR2STS
SCHEMBL11833595 0.84 PGR (0.51) MIFMAOBADORA3PON1ESR2
SCHEMBL10024076 0.84 MIF (0.77) MIFMAOBADORA3PON1MAOA
SCHEMBL11210182 0.83 MIF (0.64) MIFMAOBADORA3PON1MAOA
SCHEMBL11753022 0.82 STS (0.58) MIFSTS
SCHEMBL11827935 0.81 STS (0.51) MIFMAOBADORA3PON1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3968119-A OPTICAL BRIGHTENERS BAYER AKTIENGESELLSCHAFT (DT) 1976-07-06 — — US disclosed
Send feedback