SCHEMBL9326337

SCHEMBL9326337

CCCNN(C)CCCN

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.40
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
CHRM2 P08172 1/20 0.36
DNM1 Q05193 8/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
ALDH1A1 P00352 1/20 0.35
TSHR P16473 1/20 0.35
EPHX1 P07099 1/20 0.35

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
SCHEMBL2886639 0.83 DNM1 (0.36) DNM1ALDH1A1TSHREPHX1
SCHEMBL13087202 0.82 TDP1 (0.45) TDP1CYP2C9CYP2C19CHRM2DNM1
SCHEMBL16121480 0.81
SCHEMBL2852729 0.81 DNM1 (0.46) DNM1ALDH1A1TSHREPHX1
SCHEMBL2887340 0.78
SCHEMBL6051481 0.77 TDP1 (0.50) TDP1CYP2C9CYP2C19CHRM2DNM1
SCHEMBL28297084 0.74 DNM1 (0.48) TDP1CHRM2DNM1MEN1KMT2A
SCHEMBL2883356 0.73 TSHR (0.38) DNM1ALDH1A1TSHREPHX1
SCHEMBL21412944 0.73 TDP1 (0.31) TDP1
SCHEMBL12745071 0.72 TDP1 (0.32) TDP1CYP2C9CYP2C19CHRM2DNM1

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-0350618-B1 Carrier resin for pigment pastes, its preparation and use HOECHST AG (DE) 1994-02-02 EP disclosed
EP-0350618-A2 Carrier resin for pigment pastes, its preparation and use HOECHST AKTIENGESELLSCHAFT (DE) 1990-01-17 EP disclosed