SCHEMBL9211900

SCHEMBL9211900

CN(C)Cc1ccc(CNCCNCCN)o1

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PRMT6 Q96LA8 1/20 0.50
▸ ACHE P22303 16/20 0.49
▸ BCHE P06276 10/20 0.49
▸ CHRM2 P08172 1/20 0.46
▸ CYP2C9 P11712 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40

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
SCHEMBL9216895 0.97 PRMT6 (0.53) PRMT6ACHEBCHECHRM2
SCHEMBL18575565 0.82 CHRM2 (0.52) ACHECHRM2
SCHEMBL9217144 0.79 CHRM2 (0.41) PRMT6ACHEBCHECHRM2
SCHEMBL2458150 0.74 ACHE (0.74) PRMT6ACHEBCHECYP2C19
SCHEMBL26230987 0.74 CHRM2 (0.44) CHRM2
SCHEMBL10979759 0.74 PRMT6 (0.57) PRMT6ACHEBCHECYP2C19
SCHEMBL10864363 0.74 CHRM2 (0.73) CHRM2CYP2C9
SCHEMBL9212508 0.73 CHRM2 (0.45) PRMT6ACHECHRM2
SCHEMBL3453519 0.73 ACHE (0.61) PRMT6ACHEBCHECYP2C9CYP2C19
SCHEMBL10747905 0.73 PRMT6 (0.56) PRMT6ACHEBCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0413343-B1 Furan derivatives KYOWA HAKKO KOGYO KK (JP) 1995-08-02 — — EP disclosed
US-5075301-A FURAN DERIVATIVES USEFUL FOR THE TREATMENT OF GASTRO-INTESTINAL DISORDERS KYOWA HAKKO KOGYO, CO., LTD. (JP) 1991-12-24 — — US disclosed
EP-0413343-A2 Furan derivatives KYOWA HAKKO KOGYO CO., LTD. (JP) 1991-02-20 — — EP disclosed
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