SCHEMBL5124689

SCHEMBL5124689

ClCc1nnc(-c2ccc(I)cc2)o1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.68
LMNA P02545 1/20 0.68
NOTUM Q6P988 3/20 0.60
APP P05067 2/20 0.50
POLB P06746 5/20 0.49
TSHR P16473 2/20 0.49
USP2 O75604 2/20 0.49
NPC1 O15118 6/20 0.43
RAB9A P51151 5/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
HPGD P15428 1/20 0.43
GPR55 Q9Y2T6 1/20 0.43
KMT2A Q03164 3/20 0.43
SPHK2 Q9NRA0 1/20 0.43
ALOX12 P18054 1/20 0.43
HTT P42858 2/20 0.42
MAPT P10636 3/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 2/20 0.40
KCNH2 Q12809 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
SCHEMBL2640766 0.83 ALDH1A1 (0.70) ALDH1A1LMNANOTUMPOLBTSHR
SCHEMBL3423891 0.81 TSHR (0.73) ALDH1A1LMNANOTUMPOLBTSHR
SCHEMBL25916050 0.81 ALDH1A1 (0.68) ALDH1A1LMNANOTUMPOLBTSHR
SCHEMBL2640701 0.81 ALDH1A1 (0.68) ALDH1A1LMNANOTUMPOLBTSHR
SCHEMBL5117429 0.81 ALDH1A1 (0.68) ALDH1A1LMNANOTUMPOLBTSHR
SCHEMBL31049648 0.81 NOTUM (0.68) ALDH1A1LMNANOTUMAPPPOLB
SCHEMBL485159 0.81 ALDH1A1 (1.00) ALDH1A1LMNANOTUMPOLBTSHR
SCHEMBL30566766 0.80 ALDH1A1 (0.65) ALDH1A1LMNANOTUMAPPPOLB
SCHEMBL19553547 0.80 ALDH1A1 (0.65) ALDH1A1LMNANOTUMAPPPOLB
SCHEMBL2382016 0.80 APP (0.70) ALDH1A1APPPOLBTSHRNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240300932-A1 N-PHENYLIMINE DERIVATIVE AND PREPARATION METHOD AND USE THEREOF GUIZHOU UNIVERSITY (CN) 2024-09-12 US disclosed
WO-2024174317-A1 N-PHENYLIMINE-CONTAINING DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF 贵州大学 2024-08-29 WO disclosed
CN-116731003-A N-phenylimine-containing derivative, and preparation method and application thereof 贵州大学 2023-09-12 CN disclosed
US-20230265061-A1 OXADIAZOLE DERIVATIVE Sumitomo Pharma Co., Ltd. (JP) 2023-08-24 US disclosed
US-11718592-B2 Oxadiazole derivative Sumitomo Pharma Co., Ltd. (JP) 2023-08-08 US disclosed
EP-4122923-A1 OXADIAZOLE DERIVATIVE Sumitomo Pharma Co., Ltd. (JP) 2023-01-25 EP disclosed
US-7425555-B2 Heteroaryl substituted biphenyl derivatives as p38 kinase inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2008-09-16 US disclosed
US-20080214622-A1 Substituted Triazole Derivatives As Oxytocin Antagonists BROWN ALAN DANIEL 2008-09-04 US disclosed
EP-1499600-B1 HETEROARYL SUBSTITUTED BIPHENYL DERIVATIVES AS P38 KINASE INHIBITORS SMITHKLINE BEECHAM CORP (US) 2007-07-25 EP disclosed
US-20060089393-A1 Heteroaryl substituted biphenyl derivatives as p38 kinase inhibitors GLAXOSMITHKLINE LLC 2006-04-27 US disclosed
EP-1499600-A1 HETEROARYL SUBSTITUTED BIPHENYL DERIVATIVES AS P38 KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2005-01-26 EP disclosed
WO-2003093248-A1 HETEROARYL SUBSTITUTED BIPHENYL DERIVATIVES AS P38 KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2003-11-13 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 (5 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-20060089393-A1 Heteroaryl substituted biphenyl derivatives as p38 kinase inhibitors MAPK1, MAPK7, MAP3K1 ALDH1A1 661/4885LMNA 2768/4885NOTUM 3253/4885
US-20240300932-A1 N-PHENYLIMINE DERIVATIVE AND PREPARATION METHOD AND USE THEREOF PNMT, NNMT, PAH ALDH1A1 780/4885LMNA 2548/4885NOTUM 443/4885
US-11718592-B2 Oxadiazole derivative OXA1L, SCN1A, CACNA1A ALDH1A1 305/4885LMNA 4022/4885NOTUM 3472/4885
US-20080214622-A1 Substituted Triazole Derivatives As Oxytocin Antagonists OXTR, PRLHR, KISS1R ALDH1A1 3792/4885LMNA 2692/4885NOTUM 2284/4885
US-20230265061-A1 OXADIAZOLE DERIVATIVE OXA1L, SCN1A, CACNA1A ALDH1A1 305/4885LMNA 4022/4885NOTUM 3472/4885

“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.