SCHEMBL18407355

SCHEMBL18407355

CC(C)(C)c1cnc(C(=O)Nc2ccccc2)[nH]1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.48
NPC1 O15118 4/20 0.44
RAB9A P51151 4/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.43
TP53 P04637 1/20 0.43
MAPK14 Q16539 1/20 0.43
P4HTM Q9NXG6 1/20 0.42
CBLB Q13191 1/20 0.42
POLB P06746 1/20 0.41
KCNK9 Q9NPC2 1/20 0.41
ALOX15 P16050 1/20 0.41
CDK2 P24941 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
NAMPT P43490 1/20 0.41
HTT P42858 1/20 0.41
HPGD P15428 1/20 0.41
CNR1 P21554 1/20 0.40
IRAK4 Q9NWZ3 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
SCHEMBL18415348 0.80 RAB9A (0.47) LMNANPC1RAB9AKDM4EALDH1A1
SCHEMBL18233036 0.80 NPC1 (0.46) LMNANPC1RAB9AKDM4EALDH1A1
SCHEMBL18233024 0.78 MAPK14 (0.51) NPC1RAB9AALDH1A1SMN1; SMN2TP53
SCHEMBL18236197 0.78 RAB9A (0.49) NPC1RAB9AKDM4EALDH1A1SMN1; SMN2
SCHEMBL2026067 0.76 MAPT (0.56) LMNANPC1RAB9AKDM4EALDH1A1
SCHEMBL18407350 0.74 PTPN1 (0.54) LMNANPC1RAB9ASMN1; SMN2TP53
SCHEMBL18407348 0.73 NPC1 (0.50) LMNANPC1RAB9AKDM4EALDH1A1
SCHEMBL18407359 0.71 KMT2A (0.56) LMNANPC1RAB9AKDM4EALDH1A1
SCHEMBL18233055 0.70 MAPK14 (0.54) LMNANPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL18407357 0.69 KCNK9 (0.52) LMNANPC1RAB9ASMN1; SMN2MAPK14

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-10301255-B2 Hepatitis B antiviral agents ENANTA PHARMACEUTICALS, INC. (US) 2019-05-28 US disclosed
US-20170022150-A1 HEPATITIS B ANTIVIRAL AGENTS ENANTA PHARMACEUTICALS, INC. 2017-01-26 US disclosed
US-20170022150-A1 HEPATITIS B ANTIVIRAL AGENTS ENANTA PHARMACEUTICALS, INC. 2017-01-26 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-10301255-B2 Hepatitis B antiviral agents HAVCR2, ZC3HAV1, SLC10A1 LMNA 305/4885NPC1 607/4885RAB9A 1332/4885
US-20170022150-A1 HEPATITIS B ANTIVIRAL AGENTS HAVCR2, ZC3HAV1, SLC10A1 LMNA 305/4885NPC1 607/4885RAB9A 1332/4885

“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.