SCHEMBL26400072

SCHEMBL26400072

NCc1ccc(C(=O)OCCCCCCCCCCCCOC(=O)c2ccc(CN)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.59
NPC1 O15118 1/20 0.58
MAPT P10636 1/20 0.58
RAB9A P51151 1/20 0.58
ALDH1A1 P00352 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
LMNA P02545 2/20 0.53
CYP1A2 P05177 2/20 0.53
TSHR P16473 2/20 0.53
CYP2C19 P33261 2/20 0.53
CYP3A4 P08684 1/20 0.53
CYP2C9 P11712 1/20 0.53
PDE4D Q08499 1/20 0.53
STS P08842 7/20 0.50
ESR1 P03372 1/20 0.50
CYP2D6 P10635 1/20 0.50
MAPK1 P28482 1/20 0.50
NR1H2 P55055 1/20 0.50
RNASEL Q05823 1/20 0.50
SMN1; SMN2 Q16637 1/20 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
SCHEMBL27645375 0.88 TSHR (0.71) LOXL2NPC1MAPTRAB9AALDH1A1
SCHEMBL8838298 0.81 TDP1 (0.58) NPC1MAPTRAB9AALDH1A1TDP1
SCHEMBL22666595 0.81 TDP1 (0.58) NPC1MAPTRAB9AALDH1A1TDP1
SCHEMBL4334904 0.81 NPC1 (0.83) NPC1MAPTRAB9AALDH1A1TDP1
SCHEMBL4557168 0.81 NPC1 (0.83) NPC1MAPTRAB9AALDH1A1TDP1
SCHEMBL4345503 0.81 NPC1 (0.83) NPC1MAPTRAB9AALDH1A1TDP1
SCHEMBL4558859 0.81 NPC1 (0.83) NPC1MAPTRAB9AALDH1A1TDP1
SCHEMBL4329445 0.81 NPC1 (0.83) NPC1MAPTRAB9AALDH1A1TDP1
SCHEMBL17416888 0.81 NPC1 (0.83) NPC1MAPTRAB9AALDH1A1TDP1
SCHEMBL2887080 0.81 NPC1 (0.83) NPC1MAPTRAB9AALDH1A1TDP1

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-11780969-B2 Capacitive pressure sensor with bottlebrush elastomer dielectric layer for low pressure sensing THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-10-10 US disclosed