SCHEMBL18702136

SCHEMBL18702136

CC(C)(C)C(=O)N1CCN(c2ncc(-c3ccnc(Cl)c3)s2)CC1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SPR P35270 2/20 0.51
NPC1 O15118 3/20 0.50
RAB9A P51151 3/20 0.50
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
IDE P14735 1/20 0.47
MAPT P10636 2/20 0.45
TP53 P04637 3/20 0.43
SMO Q99835 1/20 0.43
REV1 Q9UBZ9 1/20 0.42
CKS1B P61024 1/20 0.42
SKP1 P63208 1/20 0.42
SKP2 Q13309 1/20 0.42
LMNA P02545 1/20 0.39
MAPK1 P28482 1/20 0.39
DCTPP1 Q9H773 1/20 0.39
WNT3A P56704 1/20 0.39

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
SCHEMBL18711337 0.89 SPR (0.52) SPRNPC1RAB9AMEN1KMT2A
SCHEMBL18702031 0.87 SPR (0.51) SPRNPC1RAB9AMEN1KMT2A
SCHEMBL18702193 0.86 NPC1 (0.49) SPRNPC1RAB9AMEN1KMT2A
SCHEMBL18702203 0.81 MAPT (0.52) SPRNPC1RAB9AMEN1KMT2A
SCHEMBL18702201 0.80 TP53 (0.49) SPRNPC1RAB9AMEN1KMT2A
SCHEMBL18702195 0.78 SPR (0.49) SPRNPC1RAB9AMAPTTP53
SCHEMBL18711342 0.75 SPR (0.52) SPRNPC1RAB9AWNT3A
SCHEMBL18702137 0.74 TP53 (0.56) SPRNPC1RAB9AMEN1KMT2A
SCHEMBL6725572 0.74 WNT3A (0.54) MEN1KMT2AMAPTCKS1BSKP1
SCHEMBL18711340 0.72 HDAC3 (0.55) SPRNPC1RAB9AMAPTTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9963462-B2 Sepiapterin reductase inhibitors MAX-PLANCK-GESELLSCHAFT ZUR FORDERUNG DER WISSENSCHAFTEN E.V. (DE) 2018-05-08 US disclosed
US-20170096435-A1 SEPIAPTERIN REDUCTASE INHIBITORS MAX-PLANCK-GESELLSCHAFT ZUR FOERDERUNG DER WISSENSCHAFTEN E.V. (DE) 2017-04-06 US disclosed
US-20170096435-A1 SEPIAPTERIN REDUCTASE INHIBITORS MAX-PLANCK-GESELLSCHAFT ZUR FOERDERUNG DER WISSENSCHAFTEN E.V. (DE) 2017-04-06 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-20170096435-A1 SEPIAPTERIN REDUCTASE INHIBITORS SPR, QDPR, SRR SPR 1/4885NPC1 2977/4885RAB9A 4069/4885

“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.