SCHEMBL18557477

SCHEMBL18557477

CCCCC(=O)N1CCS(=O)(=O)CC1

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.58
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
TDP1 Q9NUW8 1/20 0.56
GNAI3 P08754 9/20 0.50
GNAI1 P63096 9/20 0.50
GNAO1 P09471 8/20 0.49
POLB P06746 2/20 0.47
MAPT P10636 1/20 0.47
ATM Q13315 1/20 0.47
NPC1 O15118 1/20 0.44
GPR183 P32249 1/20 0.41
NAAA Q02083 1/20 0.40

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
SCHEMBL10291288 0.93 L3MBTL1 (0.65) L3MBTL1MEN1KMT2ATDP1GNAI3
SCHEMBL12424223 0.88 L3MBTL1 (0.47) L3MBTL1MEN1KMT2ATDP1GNAI3
SCHEMBL673399 0.83
SCHEMBL19169445 0.80 ATM (0.42) L3MBTL1MEN1KMT2ATDP1GNAI3
SCHEMBL11240 0.80 L3MBTL1 (0.62) L3MBTL1MEN1KMT2ATDP1GNAI3
SCHEMBL7599563 0.79 L3MBTL1 (0.88) L3MBTL1MEN1KMT2ATDP1GNAI3
SCHEMBL8418308 0.79 BLM (0.43) L3MBTL1MEN1KMT2ATDP1
SCHEMBL18896657 0.79 L3MBTL1 (0.67) L3MBTL1MEN1KMT2ATDP1GNAI3
SCHEMBL293140 0.78 L3MBTL1 (0.60) L3MBTL1MEN1KMT2ATDP1GNAI3
SCHEMBL18896656 0.78 L3MBTL1 (0.65) L3MBTL1MEN1KMT2ATDP1GNAI3

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-20170210734-A1 Substituted Azaspiro(4.5)Decane Derivatives GRUENENTHAL GMBH (DE) 2017-07-27 US disclosed
US-9580425-B2 Pyrido[3,4-b] indoles and methods of use MEDIVATION TECHNOLOGIES, INC. (US) 2017-02-28 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-20170210734-A1 Substituted Azaspiro(4.5)Decane Derivatives OPRL1, OPRM1, OPRD1 L3MBTL1 3149/4885MEN1 4070/4885KMT2A 2875/4885

“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.