SCHEMBL10486704

SCHEMBL10486704

CCC(C)(C)CC(C)(C)N=N

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL5872451 0.76
SCHEMBL10486705 0.73
SCHEMBL8927825 0.72 TSHR (0.30) TSHRTDP1
SCHEMBL19733892 0.72 TSHR (0.30) TSHRTDP1
SCHEMBL10794688 0.71 TSHR (0.46) TSHRTDP1
SCHEMBL1637976 0.67 TSHR (0.35) TSHRTDP1
SCHEMBL2762965 0.67 TSHR (0.35) TSHRTDP1
SCHEMBL13512602 0.67
SCHEMBL16808778 0.67 PDE2A (0.30)
SCHEMBL599877 0.65 TSHR (0.50) TSHRTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4831096-A VARYING THERMAL STABILITIES PENNWALT CORPORATION (US) 1989-05-16 US disclosed
US-4604455-A REACTING TWO PRIMARY AMINES WITH SULFURYL CHLORIDE, OXIDIZING MIXTURE OF SULFAMIDE PRODUCTS PENNWALT CORPORATION (US) 1986-08-05 US disclosed