SCHEMBL10907490

SCHEMBL10907490

CN(C)N(CCCC(=O)O)C(N)=S

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.37
▸ SLC22A6 Q4U2R8 2/20 0.37
▸ TSHR P16473 6/20 0.37
▸ HDAC11 Q96DB2 6/20 0.37
▸ CYP1A2 P05177 2/20 0.37
▸ BLM P54132 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ NPSR1 Q6W5P4 2/20 0.37
▸ GABRR3 A8MPY1 1/20 0.37
▸ GABRP O00591 1/20 0.37
▸ GABRD O14764 1/20 0.37
▸ HDAC3 O15379 1/20 0.37
▸ GABBR2 O75899 1/20 0.37
▸ THRB P10828 1/20 0.37
▸ GABRA1 P14867 1/20 0.37
▸ GABRB1 P18505 1/20 0.37
▸ GABRG2 P18507 1/20 0.37
▸ GABRR1 P24046 1/20 0.37
▸ GABRB3 P28472 1/20 0.37
▸ GABRR2 P28476 1/20 0.37

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
SCHEMBL10903614 0.84 LMNA (0.40) LMNASLC22A6TSHRHDAC11CYP1A2
SCHEMBL10907540 0.78 ALDH1A1 (0.36) LMNASLC22A6TSHRPHF8KDM2A
SCHEMBL10903599 0.78 LMNA (0.42) LMNASLC22A6TSHRHDAC11KMT2A
SCHEMBL10903601 0.74 CAMK2A (0.44) LMNASLC22A6TSHRPHF8KDM2A
SCHEMBL10905757 0.74 AKR1B1 (0.46) SLC22A6TSHRHDAC11KMT2AHDAC3
SCHEMBL10906197 0.73 KDM4C (0.38) LMNASLC22A6TSHRPHF8KDM2A
SCHEMBL10906138 0.73 TSHR (0.45) LMNASLC22A6TSHRKMT2APHF8
SCHEMBL10906590 0.72 LMNA (0.46) LMNASLC22A6TSHRHDAC11KMT2A
SCHEMBL10903589 0.72 ABCC4 (0.38) LMNASLC22A6TSHRHDAC11KMT2A
SCHEMBL10906605 0.72 AKR1B1 (0.59) SLC22A6TSHRHDAC11KMT2APHF8

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-4633014-A ANTIARRHYTHMIA AGENTS INSTITUT ORGANICHESKOGO SINTEZA AKADEMII NAUK LATVIISKOI SSR 1986-12-30 — — US disclosed
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