SCHEMBL8627875

SCHEMBL8627875

CC1(C)CC(CCCCNNCCCNCCNCCCNc2ncncn2)CC(C)(C)N1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 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
SCHEMBL27775969 0.91 TSHR (0.36) TSHR
SCHEMBL27775489 0.89 TSHR (0.35) TSHR
SCHEMBL7945324 0.78 CA12 (0.32) TSHR
SCHEMBL11168811 0.76 TSHR (0.36) TSHR
SCHEMBL9367808 0.75 TSHR (0.36) TSHR
SCHEMBL3952306 0.71 TSHR (0.30) TSHR
SCHEMBL11250098 0.70 TSHR (0.33) TSHR
SCHEMBL692463 0.70 KMT2A (0.40) TSHR
SCHEMBL9249642 0.70 TSHR (0.36) TSHR
SCHEMBL10907331 0.70 KCNH3 (0.38) TSHR

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-5767179-A INFRARED ABSORBERS FUJI CHEMICAL INDUSTRY CO., LTD. (JP) 1998-06-16 US disclosed