SCHEMBL19901772

SCHEMBL19901772

CCCCCCC(CCCCC)C(CC)NCCCC

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.35
SLC2A1 P11166 1/20 0.35
EPHX1 P07099 3/20 0.34
DNM1 Q05193 2/20 0.34
ADH1B P00325 1/20 0.34
ADH1C P00326 1/20 0.34
ADH1A P07327 1/20 0.34
ADH4 P08319 1/20 0.34
ADH7 P40394 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
SMPD1 P17405 3/20 0.33
OPRM1 P35372 1/20 0.33
TSHR P16473 1/20 0.33
THRB P10828 1/20 0.33
ZDHHC7 Q9NXF8 1/20 0.32

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
SCHEMBL14623987 0.88 ALDH1A1 (0.37) KDM4EALDH1A1LMNASLC2A1EPHX1
SCHEMBL9207449 0.86 ALDH1A1 (0.39) KDM4EALDH1A1EPHX1DNM1ADH1B
SCHEMBL27427558 0.85 DNM1 (0.36) KDM4EALDH1A1LMNASLC2A1EPHX1
SCHEMBL14679361 0.78 LMNA (0.38) LMNAEPHX1DNM1ADH1BADH1C
SCHEMBL11252411 0.77 ADH1B (0.39) KDM4EALDH1A1LMNASLC2A1EPHX1
SCHEMBL9407565 0.75 TSHR (0.37) ALDH1A1TSHR
SCHEMBL9205945 0.74 EPHX1 (0.42) KDM4ELMNASLC2A1EPHX1DNM1
SCHEMBL117250 0.74 EPHX1 (0.42) KDM4ELMNASLC2A1EPHX1DNM1
SCHEMBL25560568 0.74 EPHX1 (0.42) KDM4ELMNASLC2A1EPHX1DNM1
SCHEMBL9213526 0.74 EPHX1 (0.42) KDM4ELMNASLC2A1EPHX1DNM1

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-9902703-B2 Somatostatin modulators and uses thereof Crinetics Pharmaceuticals, Inc. (US) 2018-02-27 US disclosed