SCHEMBL11209800

SCHEMBL11209800

NN1CCC(CCc2ccccc2)CC1

nearest known ligand 0.67

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.59
MAOB P27338 1/20 0.59
CARM1 Q86X55 1/20 0.56
PRMT6 Q96LA8 1/20 0.56
CTSS P25774 2/20 0.55
CTSK P43235 2/20 0.55
CTSL P07711 1/20 0.55
CTSB P07858 1/20 0.55
CTSC P53634 1/20 0.55
CCR3 P51677 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
Formic Acid SCHEMBL27732454 0.91 MAOA (0.51) MAOAMAOBCARM1PRMT6CTSS
SCHEMBL19184907 0.89 CTSS (0.60) MAOAMAOBCARM1PRMT6CTSS
SCHEMBL27712291 0.82 MAOA (0.65) MAOAMAOBCARM1PRMT6CTSS
SCHEMBL1609623 0.82 MAOA (0.58) MAOAMAOBCARM1PRMT6CTSS
SCHEMBL10071184 0.81 CARM1 (0.65) MAOAMAOBCARM1PRMT6CTSS
SCHEMBL16385915 0.81 MAOA (0.59) MAOAMAOBCARM1PRMT6CTSS
SCHEMBL27718598 0.81 MAOA (0.59) MAOAMAOBCARM1PRMT6CTSS
Formic Acid SCHEMBL27732452 0.81 SLC18A3 (0.54) MAOAMAOBCCR3
SCHEMBL3822693 0.81 CCR3 (0.65) CARM1PRMT6CCR3
SCHEMBL15062246 0.80 MAOB (0.46) MAOAMAOBCARM1PRMT6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0042570-B1 20-DEOXYROSARAMICIN DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SCHERING CORPORATION (US) 1983-10-19 EP disclosed
EP-0042570-A1 20-Deoxyrosaramicin derivatives, process for their preparation and pharmaceutical compositions containing them SCHERING CORPORATION (US) 1981-12-30 EP disclosed
US-4279896-A Novel 20-imino macrolide antibacterial agents SCHERING CORPORATION (US) 1981-07-21 US disclosed