SCHEMBL20626535

SCHEMBL20626535

CC(C)C(C)CCNC1CCNCC1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SOS1 Q07889 1/20 0.51
GNAI3 P08754 2/20 0.49
GNAO1 P09471 2/20 0.49
GNAI1 P63096 2/20 0.49
KCNH2 Q12809 1/20 0.38
RAD52 P43351 1/20 0.36
MEN1 O00255 1/20 0.33
MITF O75030 1/20 0.33
KMT2A Q03164 1/20 0.33
DPP7 Q9UHL4 1/20 0.33
EPHX1 P07099 2/20 0.32

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
SCHEMBL6960762 0.84 SOS1 (0.54) SOS1GNAI3GNAO1GNAI1KCNH2
SCHEMBL22084809 0.82 KDM4E (0.37) SOS1RAD52MEN1MITFKMT2A
SCHEMBL27909545 0.81 SOS1 (0.51) SOS1GNAI3GNAO1GNAI1KCNH2
SCHEMBL21218127 0.79 GNAI3 (0.51) SOS1GNAI3GNAO1GNAI1KCNH2
Butane SCHEMBL27323486 0.78 GNAI3 (0.59) SOS1GNAI3GNAO1GNAI1KCNH2
SCHEMBL20648825 0.77 GNAI3 (0.58) SOS1GNAI3GNAO1GNAI1KCNH2
SCHEMBL22415116 0.76 GNAI3 (0.56) SOS1GNAI3GNAO1GNAI1KCNH2
SCHEMBL19560897 0.76 GNAI3 (0.61) SOS1GNAI3GNAO1GNAI1KCNH2
SCHEMBL8851791 0.74 GNAI3 (0.50) SOS1GNAI3GNAO1GNAI1KCNH2
SCHEMBL19604920 0.74 GNAI3 (0.64) SOS1GNAI3GNAO1GNAI1KCNH2

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-10172858-B2 Combination pharmaceutical compositions and uses thereof INTELLIKINE LLC (US) 2019-01-08 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 (1 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-10172858-B2 Combination pharmaceutical compositions and uses thereof CDC25C, CCNC, CDC25B SOS1 1463/4885GNAI3 3349/4885GNAO1 4447/4885

“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.