SCHEMBL9816779

SCHEMBL9816779

CNC(=O)N(C)C1CCCCCCC1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.54
RAB9A P51151 4/20 0.49
POLB P06746 4/20 0.47
ABCC1 P33527 2/20 0.47
KMT2A Q03164 2/20 0.46
FAAH O00519 1/20 0.45
PHGDH O43175 1/20 0.45
MGLL Q99685 1/20 0.45
ALDH1A1 P00352 2/20 0.44
NPC1 O15118 4/20 0.44
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
ADH1C P00326 1/20 0.40
ADH1A P07327 1/20 0.40
KCNH2 Q12809 1/20 0.40
MEN1 O00255 1/20 0.40
GAA P10253 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL965411 1.00 ATM (0.54) ATMRAB9APOLBABCC1KMT2A
SCHEMBL965799 0.98 ATM (0.51) ATMRAB9APOLBABCC1KMT2A
SCHEMBL969177 0.96 ATM (0.49) ATMRAB9APOLBABCC1KMT2A
SCHEMBL967284 0.89
SCHEMBL12745101 0.81 ATM (0.53) ATMRAB9APOLBABCC1KMT2A
SCHEMBL12385852 0.81 ATM (0.38) ATMRAB9APOLBABCC1KMT2A
SCHEMBL11209209 0.80 TSHR (0.50) ATMRAB9AKMT2APHGDHALDH1A1
SCHEMBL2875858 0.80 ATM (0.40) ATMRAB9APOLBABCC1KMT2A
SCHEMBL24723356 0.79 PIK3CD (0.40) ATMRAB9APOLBABCC1KMT2A
SCHEMBL679618 0.79 CCR5 (0.52) ATMRAB9APOLBABCC1KMT2A

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
EP-0135714-B1 SUSTAINED RELEASE COMPOSITIONS FOR BIOLOGICALLY ACTIVE MATERIALS MELAMINE CHEMICALS, INC. (US) 1991-11-06 EP disclosed
US-3962307-A HERBICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1976-06-08 US disclosed