SCHEMBL18229802

SCHEMBL18229802

CCCCCCCCCCC(CC)CP.CCCCCCCCCCCCP

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.46
ALDH1A1 P00352 3/20 0.41
TDP1 Q9NUW8 1/20 0.41
CYP3A4 P08684 3/20 0.40
TSHR P16473 2/20 0.40
SPHK1 Q9NYA1 2/20 0.38
DNM1 Q05193 2/20 0.36
PRSS1 P07477 1/20 0.36
PRSS2 P07478 1/20 0.36
PRSS3 P35030 1/20 0.36
CYP2D6 P10635 2/20 0.35
GMNN O75496 1/20 0.35
POLB P06746 1/20 0.35
THPO P40225 1/20 0.35
MTOR P42345 1/20 0.35
BLM P54132 1/20 0.35
KDM4E B2RXH2 1/20 0.35
TP53 P04637 1/20 0.35
CYP1A2 P05177 1/20 0.35
MAPT P10636 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
SCHEMBL18229828 1.00 LMNA (0.46) LMNAALDH1A1TDP1CYP3A4TSHR
SCHEMBL10000313 0.93 LMNA (0.52) LMNAALDH1A1TDP1CYP3A4TSHR
SCHEMBL28661364 0.86 LMNA (0.54) LMNACYP3A4TSHRSPHK1DNM1
SCHEMBL28509007 0.86 LMNA (0.54) LMNACYP3A4TSHRSPHK1DNM1
SCHEMBL13474493 0.84 ALDH1A1 (0.46) LMNAALDH1A1TDP1CYP3A4TSHR
SCHEMBL28661366 0.84 LMNA (0.56) LMNAALDH1A1TDP1TSHRSPHK1
SCHEMBL3912510 0.84
SCHEMBL28502652 0.84 LMNA (0.56) LMNAALDH1A1TDP1TSHRSPHK1
SCHEMBL28503653 0.84 LMNA (0.56) LMNAALDH1A1TDP1TSHRSPHK1
SCHEMBL28509008 0.84 LMNA (0.56) LMNAALDH1A1TDP1TSHRSPHK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4121407-A1 Catalytic process for preparing an alpha, Beta-ethylenically unsaturated carboxylic acid salt BASF SE (DE) 2023-01-25 EP disclosed
WO-2021185879-A1 CATALYTIC PROCESS FOR PREPARING AN α,β-ETHYLENICALLY UNSATURATED CARBOXYLIC ACID SALT BASF SE (DE) 2021-09-23 WO disclosed
EP-3442939-A1 PROCESS FOR PREPARING AN UNSATURATED CARBOXYLIC ACID SALT BASF SE (DE) 2019-02-20 EP disclosed
EP-3294701-A1 PROCESS FOR PREPARING AN UNSATURATED CARBOXYLIC ACID SALT BASF SE (DE) 2018-03-21 EP disclosed
WO-2017178282-A1 PROCESS FOR PREPARING AN UNSATURATED CARBOXYLIC ACID SALT BASF SE (DE) 2017-10-19 WO disclosed
WO-2016180775-A1 PROCESS FOR PREPARING AN UNSATURATED CARBOXYLIC ACID SALT BASF SE (DE) 2016-11-17 WO disclosed