SCHEMBL6741275

SCHEMBL6741275

CCC(N1CCN(C2CCCCC2)CCN(C2CCCCC2)CC1)N1CCN(C2CCCCC2)CCN(C2CCCCC2)CC1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.53
TSHR P16473 6/20 0.49
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
PHGDH O43175 1/20 0.43
MGLL Q99685 1/20 0.43
TP53 P04637 1/20 0.41
ALDH1A1 P00352 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
USP2 O75604 1/20 0.39
CHRM2 P08172 3/20 0.38
CHRM1 P11229 3/20 0.38

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
SCHEMBL20094631 0.80 SIGMAR1 (0.49) SIGMAR1TSHRMEN1KMT2APHGDH
SCHEMBL6743387 0.77 SIGMAR1 (0.46) SIGMAR1TSHRMEN1KMT2APHGDH
SCHEMBL12858869 0.77 HRH3 (0.53) SIGMAR1TSHRMEN1KMT2APHGDH
SCHEMBL8186259 0.77 HRH3 (0.53) SIGMAR1TSHRMEN1KMT2APHGDH
SCHEMBL24302231 0.75 PHGDH (0.56) SIGMAR1MEN1KMT2APHGDHMGLL
SCHEMBL584039 0.75
SCHEMBL5784736 0.75 PHGDH (0.56) SIGMAR1MEN1KMT2APHGDHMGLL
SCHEMBL6664812 0.75 PHGDH (0.56) SIGMAR1MEN1KMT2APHGDHMGLL
SCHEMBL6245189 0.75 PHGDH (0.56) SIGMAR1MEN1KMT2APHGDHMGLL
SCHEMBL9695357 0.75

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-6689919-B1 SOLUBLE POLY(OXYFLUOROPHENYLENE) COMPOUNDS WITH EXCELLENT HEAT RESISTANCE, MEMBRANE-FORMABILITY AND CHEMICAL STABILITY JAPAN SCIENCE AND TECHNOLOGY CORPORATION (JP) 2004-02-10 US disclosed