SCHEMBL24671763

SCHEMBL24671763

O=C(NCCCC1CCCN1Cc1ccccc1)C(c1ccccc1)c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 4/20 0.55
SLC6A3 Q01959 4/20 0.55
CNR1 P21554 3/20 0.53
SLC6A4 P31645 1/20 0.51
CNR2 P34972 2/20 0.50
RAB9A P51151 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
SCHEMBL17294704 0.86 CCR2 (0.54) SLC6A2SLC6A3
SCHEMBL11199921 0.74 SPHK2 (0.51)
SCHEMBL19946922 0.73 CCR2 (0.61)
SCHEMBL19946919 0.73 CCR2 (0.61)
SCHEMBL8414527 0.73 SPHK2 (0.47)
SCHEMBL30150926 0.73 SPHK2 (0.54)
SCHEMBL17152570 0.72 OPRD1 (0.46)
SCHEMBL16416519 0.72 VEGFA (0.64)
SCHEMBL7984234 0.72 SIGMAR1 (0.53)
SCHEMBL8967844 0.72 SPHK2 (0.46)

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
EP-3148518-B1 NOVEL COMPOUNDS AS ANTI-TUBERCULAR AGENTS SPHAERA PHARMA PRIVATE LTD (IN) 2022-11-30 EP disclosed