SCHEMBL7073963

SCHEMBL7073963

C=CCN(CC=C)c1ccc(/C=C/c2ccccc2)c(C(=O)C(F)(F)F)c1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ DHFR P00374 4/20 0.37
▸ CTDSP1 Q9GZU7 1/20 0.36
▸ PTPN1 P18031 3/20 0.35
▸ RELA Q04206 1/20 0.34
▸ RAB9A P51151 2/20 0.33
▸ SNCA P37840 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ CASP3 P42574 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ CYP1B1 Q16678 1/20 0.33
▸ SENP8 Q96LD8 1/20 0.33
▸ SENP7 Q9BQF6 1/20 0.33
▸ SENP6 Q9GZR1 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ EGFR P00533 1/20 0.33
▸ CAPN1 P07384 1/20 0.33

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
SCHEMBL6933530 0.76 CYP19A1 (0.44) ALDH1A1PTPN1MAPTKMT2ACYP1B1
SCHEMBL6933534 0.76 CYP19A1 (0.44) ALDH1A1PTPN1MAPTKMT2ACYP1B1
SCHEMBL15273222 0.74 TRPA1 (0.47) SMN1; SMN2ALDH1A1PTPN1SNCAMAPT
SCHEMBL15273217 0.74 TRPA1 (0.47) SMN1; SMN2ALDH1A1PTPN1SNCAMAPT
SCHEMBL10886298 0.73 RELA (0.57) SMN1; SMN2ALDH1A1CTDSP1RELARAB9A
SCHEMBL11525076 0.69 MEN1 (0.42) SMN1; SMN2ALDH1A1DHFRPTPN1MAPT
SCHEMBL7073967 0.67 AKR1C1 (0.42) ALDH1A1RAB9AMAPTKMT2AKDM4E
SCHEMBL4940765 0.66 NFE2L2 (0.43) SMN1; SMN2ALDH1A1PTPN1RELAKMT2A
SCHEMBL4940752 0.66 NFE2L2 (0.43) SMN1; SMN2ALDH1A1PTPN1RELAKMT2A
SCHEMBL3887432 0.65 ALDH1A1 (0.49) SMN1; SMN2ALDH1A1RAB9ANPC1KMT2A

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-0953150-B1 MODULAR SENSOR SYSTEM FOR THE INDUSTRIAL PROCESS MEASUREMENT TECHNIQUE EIDGENOESSISCHE TECH HOCHSCHULE ZUERICH (CH) 2003-01-15 — — EP disclosed
EP-0953150-A1 MODULAR SENSOR SYSTEM FOR THE INDUSTRIAL PROCESS MEASUREMENT TECHNIQUE Eidgenössische Technische Hochschule Zürich (CH) 1999-11-03 — — EP disclosed
WO-1998030892-A1 MODULAR SENSOR SYSTEM FOR THE INDUSTRIAL PROCESS MEASUREMENT TECHNIQUE Eidgenössische Technische Hochschule Zürich (CH) 1998-07-16 — — WO disclosed
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