SCHEMBL9713316

SCHEMBL9713316

CCC(C)(CC)c1nnc(NC(=O)c2ccccc2Cl)s1

nearest known ligand 0.63

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.63
ALDH1A1 P00352 1/20 0.63
NPSR1 Q6W5P4 1/20 0.63
ABL1 P00519 5/20 0.54
SRC P12931 5/20 0.54
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
RAB9A P51151 2/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
NPC1 O15118 1/20 0.51
RXFP1 Q9HBX9 1/20 0.51
LMNA P02545 2/20 0.51
TP53 P04637 2/20 0.50

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
SCHEMBL9713091 0.86 MEN1 (0.53) MAPTALDH1A1NPSR1MEN1KMT2A
SCHEMBL9713679 0.83 NPC1 (0.65) MAPTALDH1A1MEN1KMT2ARAB9A
SCHEMBL9713079 0.83 ALDH1A1 (0.52) MAPTALDH1A1NPSR1RAB9ASMN1; SMN2
SCHEMBL9712817 0.82 SMN1; SMN2 (0.59) MAPTALDH1A1NPSR1SRCMEN1
SCHEMBL9713682 0.81 KMT2A (0.46) MAPTALDH1A1NPSR1MEN1KMT2A
SCHEMBL9713044 0.78 MEN1 (0.54) MAPTALDH1A1NPSR1ABL1MEN1
SCHEMBL9712603 0.78 MEN1 (0.54) MAPTALDH1A1NPSR1ABL1MEN1
SCHEMBL9713074 0.77 TAS1R3 (0.48) MAPTALDH1A1ABL1MEN1KMT2A
SCHEMBL9713276 0.75 MEN1 (0.51) MAPTALDH1A1NPSR1ABL1MEN1
SCHEMBL9713494 0.75 ALDH1A1 (0.67) MAPTALDH1A1ABL1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5086184-A Herbicides DOWELANCO (US) 1992-02-04 US disclosed
US-4943634-A HERBICIDES ELI LILLY AND COMPANY (US) 1990-07-24 US disclosed
US-4801718-A HERBICIDES ELI LILLY AND COMPANY (US) 1989-01-31 US disclosed
US-4636243-A HERBICIDES ISOXAZOLES ELI LILLY AND COMPANY (US) 1987-01-13 US disclosed
US-4515625-A HERBICIDES ELI LILLY AND COMPANY (US) 1985-05-07 US disclosed
EP-0049071-B1 N-ARYLBENZAMIDE DERIVATIVES ELI LILLY AND COMPANY (US) 1984-12-19 EP disclosed
US-4416683-A HERBICIDES ELI LILLY AND COMPANY (US) 1983-11-22 US disclosed
EP-0049071-A1 N-arylbenzamide derivatives ELI LILLY AND COMPANY (US) 1982-04-07 EP disclosed