SCHEMBL18069380

SCHEMBL18069380

Cc1cnn2ccc(C(C)(C)C)nc12

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SCN5A Q14524 1/20 0.47
▸ SMPD3 Q9NY59 6/20 0.40
▸ FLT3 P36888 7/20 0.34
▸ CCNT1 O60563 4/20 0.34
▸ PIK3CA P42336 4/20 0.34
▸ CDK9 P50750 4/20 0.34
▸ LMNA P02545 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ CDK7 P50613 2/20 0.31
▸ NPC1 O15118 2/20 0.31
▸ RAB9A P51151 2/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ CCR4 P51679 1/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ ATM Q13315 1/20 0.30
▸ L3MBTL1 Q9Y468 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
SCHEMBL21211267 0.84 SCN5A (0.52) SCN5ASMPD3LMNAKDM4E
SCHEMBL21370421 0.82 SCN5A (0.38) SCN5ASMPD3LMNASMN1; SMN2NPC1
SCHEMBL10308911 0.77 SCN5A (0.48) SCN5ASMPD3FLT3CCNT1PIK3CA
SCHEMBL17830895 0.76 SCN5A (0.47) SCN5ASMPD3FLT3CCNT1PIK3CA
SCHEMBL26352050 0.74 TGFBR1 (0.46) —
SCHEMBL15280676 0.74 PIM1 (0.49) SCN5ASMPD3
SCHEMBL21941666 0.74 SCN5A (0.49) SCN5ASMPD3FLT3PIK3CA
SCHEMBL31624120 0.73 MEN1 (0.46) SMN1; SMN2NPC1RAB9AKDM4EMAPT
SCHEMBL17132558 0.71 SCN5A (0.43) SCN5ASMPD3KDM4E
SCHEMBL13990583 0.71 TGFBR2 (0.50) SCN5ASMPD3

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-9981944-B2 GDF-8 inhibitors RIGEL PHARMACEUTICALS, INC (US) 2018-05-29 — — US disclosed
US-20160264553-A1 GDF-8 Inhibitors MIDCAP FINANCIAL TRUST 2016-09-15 — — 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-20160264553-A1 GDF-8 Inhibitors CXCL8, MSTN, LGALS8 SCN5A 2254/4885SMPD3 1963/4885FLT3 325/4885

“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.

Send feedback