SCHEMBL19145149

SCHEMBL19145149

Cc1ccc(CN(C)CNC(=N)N)s1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.43
PRMT6 Q96LA8 1/20 0.39
TRPM8 Q7Z2W7 1/20 0.33
TP53 P04637 1/20 0.33
THRB P10828 1/20 0.33
POLB P06746 1/20 0.33
KMT2A Q03164 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
HDAC3 O15379 1/20 0.32
HDAC4 P56524 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
TAS1R3 Q7RTX0 1/20 0.31
TAS1R1 Q7RTX1 1/20 0.31
PLAU P00749 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
SCHEMBL14868630 0.76 RIPK1 (0.47) RIPK1PRMT6TRPM8TP53THRB
SCHEMBL14868658 0.71 RIPK1 (0.43) RIPK1PRMT6TRPM8TP53THRB
SCHEMBL10154745 0.71 RIPK1 (0.50) RIPK1PRMT6TRPM8TP53THRB
SCHEMBL14868587 0.71 RIPK1 (0.48) RIPK1PRMT6TRPM8TP53THRB
SCHEMBL14868625 0.70 PRMT6 (0.46) RIPK1PRMT6TP53THRBKMT2A
SCHEMBL19144917 0.70 HSD11B1 (0.37) TRPM8KMT2A
SCHEMBL14868749 0.69 PRMT6 (0.49) PRMT6TP53THRBPOLBKMT2A
SCHEMBL8015367 0.68 PRMT6 (0.50) RIPK1PRMT6TRPM8TP53THRB
SCHEMBL14868734 0.68 PRMT6 (0.37) RIPK1PRMT6TP53THRBPOLB
SCHEMBL14868739 0.68 PRMT6 (0.37) RIPK1PRMT6TP53THRBKMT2A

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-10028923-B2 Biguanide compositions and methods of treating metabolic disorders ELCELYX THERAPEUTICS, INC. (US) 2018-07-24 US disclosed
US-20170202790-A1 Biguanide Compositions and Methods of Treating Metabolic Disorders ANJI PHARMACEUTICALS INC. 2017-07-20 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170202790-A1 Biguanide Compositions and Methods of Treating Metabolic Disorders SLC5A2, SLC5A1, GPR119 RIPK1 3097/4885PRMT6 1349/4885TRPM8 2283/4885
US-10028923-B2 Biguanide compositions and methods of treating metabolic disorders SLC5A2, SLC5A1, GPR119 RIPK1 3097/4885PRMT6 1349/4885TRPM8 2283/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.