SCHEMBL4523017

SCHEMBL4523017

N[C@@H](Cc1cnc2ccccc2n1)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.55
CYP2C9 P11712 1/20 0.55
HIF1A Q16665 1/20 0.55
PDE10A Q9Y233 1/20 0.51
ALPI P09923 1/20 0.50
PKM P14618 1/20 0.50
PTGS1 P23219 1/20 0.50
XIAP P98170 1/20 0.50
SLC7A5 Q01650 1/20 0.50
HSD17B10 Q99714 2/20 0.47
ALDH1A1 P00352 1/20 0.47
HPGD P15428 1/20 0.47
ALOX15 P16050 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
MAPT P10636 1/20 0.45
KDM4E B2RXH2 1/20 0.44

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
SCHEMBL23782003 1.00 CYP1A2 (0.55) CYP1A2CYP2C9HIF1APDE10AALPI
Hydrochloric Acid SCHEMBL6408746 0.98 CYP1A2 (0.53) CYP1A2CYP2C9HIF1APDE10AALPI
SCHEMBL19462808 0.81 CYP1A2 (0.42) CYP1A2CYP2C9HIF1APDE10AALPI
SCHEMBL29430134 0.79 CYP1A2 (0.53) CYP1A2ALPIPKMPTGS1XIAP
SCHEMBL502039 0.79 CYP1A2 (0.53) CYP1A2ALPIPKMPTGS1XIAP
SCHEMBL839033 0.79 CYP1A2 (0.53) CYP1A2ALPIPKMPTGS1XIAP
SCHEMBL502040 0.79 CYP1A2 (0.53) CYP1A2ALPIPKMPTGS1XIAP
Dl-Phenylalanine SCHEMBL28044913 0.79 SLC7A5 (0.59) CYP1A2CYP2C9HIF1AALPIPKM
SCHEMBL4529374 0.76 CYP1A2 (0.50) CYP1A2CYP2C9HIF1APDE10AHSD17B10
SCHEMBL31614353 0.76 TPH1 (0.62) HIF1AALPIPKMPTGS1XIAP

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 89 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025094171-A1 SUPERHYDROPHOBIC COATING YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2025-05-08 WO claimed
US-20240247034-A1 CYSTINE KNOT SCAFFOLD PLATFORM GENENTECH INC (US) 2024-07-25 US claimed
EP-4401555-A1 ANTIMICROBIAL PEPTIDES YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD (IL) 2024-07-24 EP claimed
US-20230174596-A1 CYSTINE KNOT SCAFFOLD PLATFORM GENENTECH INC (US) 2023-06-08 US claimed
WO-2023042201-A1 ANTIMICROBIAL PEPTIDES YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2023-03-23 WO claimed
CN-114805528-A Cystine knot scaffold platform 豪夫迈·罗氏有限公司 2022-07-29 CN claimed
CN-114591422-A Cystine knot scaffold platform 豪夫迈·罗氏有限公司 2022-06-07 CN claimed
US-20200325187-A1 CYSTINE KNOT SCAFFOLD PLATFORM GENENTECH, INC. (US) 2020-10-15 US claimed
US-20200231636-A1 CYSTINE KNOT SCAFFOLD PLATFORM GENENTECH INC (US) 2020-07-23 US claimed
EP-2951195-B1 ANTIFOULING MATERIALS YISSUM RES DEV CO OF HEBREW UNIV JERUSALEM LTD (IL) 2020-02-19 EP claimed
EP-3374520-A1 BIOSENSORS Yissum Research and Development Company of the Hebrew University of Jerusalem Ltd. (IL) 2018-09-19 EP claimed
EP-3350215-A1 CYSTINE KNOT SCAFFOLD PLATFORM H. Hoffnabb-La Roche Ag (CH) 2018-07-25 EP claimed
CN-108026162-A Cystine knot scaffold platform 豪夫迈·罗氏有限公司 2018-05-11 CN claimed
WO-2017081684-A1 BIOSENSORS YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD (IL) 2017-05-18 WO claimed
US-20170129927-A1 CYSTINE KNOT SCAFFOLD PLATFORM GENENTECH INC (US) 2017-05-11 US claimed
US-9631100-B2 Antifouling materials YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2017-04-25 US claimed
WO-2017049009-A1 CYSTINE KNOT SCAFFOLD PLATFORM GENENTECH, INC. (US) 2017-03-23 WO claimed
US-20150368480-A1 ANTIFOULING MATERIALS YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD (IL) 2015-12-24 US claimed
EP-2951195-A1 ANTIFOULING MATERIALS Yissum Research Development Company of The Hebrew University of Jerusalem Ltd. (IL) 2015-12-09 EP claimed
WO-2014118779-A1 ANTIFOULING MATERIALS YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2014-08-07 WO claimed

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-20240247034-A1 CYSTINE KNOT SCAFFOLD PLATFORM LRP6, LDLR, KDR CYP1A2 4502/4885CYP2C9 3847/4885HIF1A 690/4885
US-20150368480-A1 ANTIFOULING MATERIALS PFAS, FLNB, FLNA CYP1A2 1080/4885CYP2C9 1078/4885HIF1A 1986/4885

“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.