SCHEMBL9211328

SCHEMBL9211328

CCCCCCCCCCCCC1(CN)CCCC1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 8/20 0.39
TSHR P16473 3/20 0.39
ALDH1A1 P00352 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
EPHX1 P07099 1/20 0.39
USP2 O75604 1/20 0.36
LMNA P02545 1/20 0.36
CYP1A2 P05177 1/20 0.36
BLM P54132 1/20 0.36
CACNA2D1 P54289 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
THRB P10828 1/20 0.35
SIRT2 Q8IXJ6 1/20 0.33
GNAI3 P08754 1/20 0.31
GNAO1 P09471 1/20 0.31
GNAI1 P63096 1/20 0.31

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
SCHEMBL9210517 1.00 DNM1 (0.39) DNM1TSHRALDH1A1MEN1KMT2A
SCHEMBL9213235 1.00 DNM1 (0.39) DNM1TSHRALDH1A1MEN1KMT2A
SCHEMBL9210728 0.96 DNM1 (0.39) DNM1TSHRALDH1A1MEN1KMT2A
SCHEMBL9876653 0.93 DNM1 (0.35) DNM1TSHRALDH1A1MEN1KMT2A
SCHEMBL16985042 0.89 USP2 (0.42) TSHRALDH1A1USP2LMNACYP1A2
SCHEMBL7077181 0.89 USP2 (0.42) TSHRALDH1A1USP2LMNACYP1A2
SCHEMBL20374717 0.89 DNM1 (0.38) DNM1TSHRALDH1A1MEN1KMT2A
SCHEMBL16985055 0.86 ALDH1A1 (0.34) DNM1TSHRALDH1A1MEN1KMT2A
SCHEMBL28859416 0.86 TSHR (0.42) DNM1TSHRALDH1A1MEN1KMT2A
SCHEMBL14109879 0.86 TSHR (0.42) DNM1TSHRALDH1A1MEN1KMT2A

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-0421441-B1 Pantothenic acid derivatives FUJIREBIO KK (JP) 1995-01-25 EP disclosed
US-5120738-A Cardiovascular disorders FUJIREBIO INC. (JP) 1992-06-09 US disclosed