SCHEMBL17874008

SCHEMBL17874008

NC(=O)c1cc(-c2cccs2)no1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RET P07949 2/20 0.46
NPC1 O15118 8/20 0.43
RAB9A P51151 7/20 0.43
MEN1 O00255 6/20 0.43
KMT2A Q03164 6/20 0.43
POLB P06746 2/20 0.43
AURKA O14965 1/20 0.42
JAK2 O60674 1/20 0.42
NTRK1 P04629 1/20 0.42
PIM1 P11309 1/20 0.42
FGFR1 P11362 1/20 0.42
PRKACA P17612 1/20 0.42
LTK P29376 1/20 0.42
KDR P35968 1/20 0.42
MAP2K2 P36507 1/20 0.42
FLT3 P36888 1/20 0.42
MAPK8 P45983 1/20 0.42
MAPK9 P45984 1/20 0.42
CSNK1A1 P48729 1/20 0.42
GSK3A P49840 1/20 0.42

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
SCHEMBL17874000 0.86 KDM4E (0.47) NPC1RAB9AMEN1KMT2ANPSR1
SCHEMBL2765551 0.84 ADORA2A (0.47) NPC1RAB9AMEN1KMT2ANPSR1
Hydrochloric Acid SCHEMBL10449721 0.82 RAB9A (0.41) RETNPC1RAB9AMEN1KMT2A
SCHEMBL14341891 0.81 MAPT (0.54) NPC1RAB9AMEN1KMT2ANPSR1
SCHEMBL18460824 0.81 RAB9A (0.48) NPC1RAB9AMEN1KMT2APOLB
SCHEMBL15001258 0.78 SMN1; SMN2 (0.41) RETNPC1RAB9AMEN1KMT2A
SCHEMBL9911655 0.76 MEN1 (0.59) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL31301239 0.75 MYC (0.41) RAB9APOLBSMN1; SMN2GAA
SCHEMBL14896296 0.75 HSD17B10 (0.50) NPC1RAB9AMEN1KMT2APIM1
SCHEMBL4280113 0.74 RAB9A (0.61) NPC1RAB9AMEN1KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220175735-A1 METHODS OF TREATING PULMONARY DISEASES AND DISORDERS PROTEOSTASIS THERAPEUTICS INC (US) 2022-06-09 US disclosed
CN-107207487-B Compounds, compositions and methods for increasing CFTR activity 蛋白质平衡治疗股份有限公司 2021-12-28 CN disclosed
EP-3237411-A2 COMPOUNDS, COMPOSITIONS, AND METHODS FOR INCREASING CFTR ACTIVITY Proteostasis Therapeutics, Inc. (US) 2017-11-01 EP disclosed
WO-2016105485-A2 COMPOUNDS, COMPOSITIONS, AND METHODS FOR INCREASING CFTR ACTIVITY PROTEOSTASIS THERAPEUTICS, INC. (US) 2016-06-30 WO 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-20220175735-A1 METHODS OF TREATING PULMONARY DISEASES AND DISORDERS SMPD1, ELANE, SMPD2 RET 4581/4885NPC1 463/4885RAB9A 1690/4885

“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.