SCHEMBL23065572

SCHEMBL23065572

Nc1ccc(OCc2ccc(OCCN3CCCCC3)cc2)c2ccccc12

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 10/20 0.61
HTT P42858 1/20 0.55
PSMB1 P20618 1/20 0.54
PSMB5 P28074 1/20 0.54
PSMB2 P49721 1/20 0.54
HRH3 Q9Y5N1 3/20 0.53
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
KCNH2 Q12809 1/20 0.49
MCHR1 Q99705 1/20 0.49
NOS3 P29474 1/20 0.49
NOS1 P29475 1/20 0.49
NOS2 P35228 1/20 0.49
KDM4E B2RXH2 1/20 0.49
ALDH1A1 P00352 1/20 0.49
NPY1R P25929 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
SCHEMBL23065565 1.00 LTA4H (0.61) LTA4HHTTPSMB1PSMB5PSMB2
Hydrochloric Acid SCHEMBL29520137 0.99 LTA4H (0.60) LTA4HHTTPSMB1PSMB5PSMB2
Hydrochloric Acid SCHEMBL23045049 0.99 LTA4H (0.60) LTA4HHTTPSMB1PSMB5PSMB2
SCHEMBL23065571 0.94 NPC1 (0.58) LTA4HHTTHRH3NPC1RAB9A
SCHEMBL23065574 0.94 NPC1 (0.58) LTA4HHTTHRH3NPC1RAB9A
SCHEMBL23065576 0.89 LTA4H (0.58) LTA4HHTTPSMB1PSMB5NPC1
SCHEMBL4246615 0.86 NOS3 (0.62) LTA4HHRH3SMN1; SMN2NOS3NOS1
SCHEMBL26185877 0.86 LTA4H (0.61) LTA4HHTTPSMB1PSMB5PSMB2
SCHEMBL23065577 0.84 LTA4H (0.60) LTA4HHRH3NOS3NOS1NOS2
SCHEMBL29374406 0.84 LTA4H (0.58) LTA4HHTTPSMB1PSMB5PSMB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230271928-A1 NAPHTHYLUREA COMPOUND, METHODS OF PREPARATION AND USE THEREOF HENAN RADIOMEDICAL SCIENCE AND TECHNOLOGY CO., LTD. (CN) 2023-08-31 US disclosed
US-20230271928-A1 NAPHTHYLUREA COMPOUND, METHODS OF PREPARATION AND USE THEREOF HENAN RADIOMEDICAL SCIENCE AND TECHNOLOGY CO., LTD. (CN) 2023-08-31 US disclosed
US-20230271928-A1 NAPHTHYLUREA COMPOUND, METHODS OF PREPARATION AND USE THEREOF HENAN RADIOMEDICAL SCIENCE AND TECHNOLOGY CO., LTD. (CN) 2023-08-31 US disclosed
WO-2022166994-A1 NAPHTHYL UREA COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF 河南省锐达医药科技有限公司 2022-08-11 WO disclosed
US-20220098162-A1 APHTHYLAMINE COMPOUND AND BIOLOGICALLY ACCEPTABLE SALT THEREOF, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF HENAN RADIOMEDICAL SCIENCE AND TECH CO LTD (CN) 2022-03-31 US disclosed
CN-112961120-B Naphthyl urea compound, preparation method and application thereof 河南省锐达医药科技有限公司 2022-02-08 CN disclosed
CN-112961120-A Naphthyl urea compound, preparation method and application thereof 河南省锐达医药科技有限公司 2021-06-15 CN disclosed
WO-2021037090-A1 NAPHTHYLAMINE COMPOUND AND BIOLOGICALLY ACCEPTABLE SALT THEREOF, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF 河南省锐达医药科技有限公司 2021-03-04 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 (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-20220098162-A1 APHTHYLAMINE COMPOUND AND BIOLOGICALLY ACCEPTABLE SALT THEREOF, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF HASPIN, SLC7A1, INMT LTA4H 2061/4885HTT 1167/4885PSMB1 4801/4885
US-20230271928-A1 NAPHTHYLUREA COMPOUND, METHODS OF PREPARATION AND USE THEREOF C1R, C9, H1-3 LTA4H 3127/4885HTT 2024/4885PSMB1 2606/4885

“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.