SCHEMBL288368

SCHEMBL288368

O=C(NCc1ccncc1)Nc1ccsc1C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.56
NAMPT P43490 7/20 0.56
MAPT P10636 1/20 0.51
ALDH1A1 P00352 2/20 0.51
ROCK2 O75116 2/20 0.51
ROCK1 Q13464 2/20 0.51
PTPN2 P17706 1/20 0.50
PTPN1 P18031 1/20 0.50
MAPK8 P45983 1/20 0.50
MAPK10 P53779 1/20 0.50
KDR P35968 1/20 0.49

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
SCHEMBL288676 0.87 CFD (0.60) ALDH1A1PTPN2PTPN1MAPK8MAPK10
SCHEMBL1285291 0.84 MEN1 (0.60) NAMPTMAPTALDH1A1ROCK2ROCK1
SCHEMBL1284978 0.84 NPC1 (0.60) MAPTALDH1A1ROCK2ROCK1PTPN2
SCHEMBL1285296 0.84 RAB9A (0.56) ALDH1A1ROCK2ROCK1PTPN2PTPN1
SCHEMBL1285277 0.80 KMT2A (0.61) HTTMAPTALDH1A1PTPN2PTPN1
SCHEMBL1285222 0.77 ABCC1 (0.63) MAPTALDH1A1PTPN2PTPN1MAPK8
SCHEMBL4574106 0.76 MAPK10 (0.72) HTTMAPTALDH1A1PTPN2PTPN1
SCHEMBL23407740 0.75 CFD (0.81) HTTNAMPTMAPTALDH1A1ROCK2
SCHEMBL1285726 0.74 MEN1 (0.62) MAPTALDH1A1ROCK2ROCK1PTPN2
SCHEMBL1286239 0.74 KMT2A (0.60) MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023200017-A1 NOVEL SEVEN-MEMBERED RING-FUSED COMPOUNDS Prism BioLab Co., Ltd. (JP) 2023-10-19 WO disclosed
EP-2427451-B1 ALPHA HELIX MIMETICS AND METHODS RELATING THERETO PRISM BIOLAB CO LTD (JP) 2019-03-20 EP disclosed
US-20180305373-A1 ALPHA HELIX MIMETICS AND METHODS RELATING THERETO Prism BioLab Co., Ltd. (JP) 2018-10-25 US disclosed
US-10017522-B2 Alpha helix mimetics and methods relating thereto Prism BioLab Co., Ltd. (JP) 2018-07-10 US disclosed
US-20150368262-A1 ALPHA HELIX MIMETICS AND METHODS RELATING THERETO Prism BioLab Co., Ltd. (JP) 2015-12-24 US disclosed
US-9040531-B2 Alpha helix mimetics and methods relating thereto Prism BioLab Co., Ltd. (JP) 2015-05-26 US disclosed
US-20120088770-A1 ALPHA HELIX MIMETICS AND METHODS RELATING THERETO PRISM BIOLAB CORPORATION (JP) 2012-04-12 US disclosed
EP-2427451-A1 ALPHA HELIX MIMETICS AND METHODS RELATING THERETO PRISM BioLab Corporation (JP) 2012-03-14 EP disclosed
WO-2010128685-A1 ALPHA HELIX MIMETICS AND METHODS RELATING THERETO PRISM BIOLAB CORPORATION (JP) 2010-11-11 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 (4 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-20150368262-A1 ALPHA HELIX MIMETICS AND METHODS RELATING THERETO PLOD3, COL1A1, THPO HTT 1135/4885NAMPT 2472/4885MAPT 1638/4885
US-20120088770-A1 ALPHA HELIX MIMETICS AND METHODS RELATING THERETO PLOD3, COL1A1, THPO HTT 1135/4885NAMPT 2472/4885MAPT 1638/4885
US-20180305373-A1 ALPHA HELIX MIMETICS AND METHODS RELATING THERETO PLOD3, COL1A1, THPO HTT 1135/4885NAMPT 2472/4885MAPT 1638/4885
US-10017522-B2 Alpha helix mimetics and methods relating thereto PLOD3, COL1A1, THPO HTT 1135/4885NAMPT 2472/4885MAPT 1638/4885

“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.