SCHEMBL30778024

SCHEMBL30778024

O/N=C(\c1c(F)cccc1I)N1CCN(c2ccccc2Cl)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
MEN1 O00255 5/20 0.41
KMT2A Q03164 5/20 0.41
TSHR P16473 3/20 0.41
AKR1C3 P42330 1/20 0.40
MAPT P10636 3/20 0.40
GAA P10253 2/20 0.40
SMN1; SMN2 Q16637 5/20 0.40
ALDH1A1 P00352 2/20 0.40
MAPK1 P28482 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HSD17B10 Q99714 1/20 0.40
KDM4E B2RXH2 2/20 0.39
USP2 O75604 1/20 0.39
GRM5 P41594 1/20 0.39
ALOX15 P16050 1/20 0.39
LMNA P02545 1/20 0.38
MAPK14 Q16539 1/20 0.38

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
SCHEMBL23283044 0.83 MEN1 (0.43) CYP1A2CYP2C9CYP2C19MEN1KMT2A
SCHEMBL23064314 0.83 AKR1C3 (0.49) MEN1KMT2AAKR1C3MAPTGAA
SCHEMBL30633892 0.83 AKR1C3 (0.49) MEN1KMT2AAKR1C3MAPTGAA
SCHEMBL23064354 0.83 AKR1C3 (0.49) MEN1KMT2AAKR1C3MAPTGAA
SCHEMBL31050090 0.83 AKR1C3 (0.49) MEN1KMT2AAKR1C3MAPTGAA
SCHEMBL24835210 0.82 CYP1A2 (0.49) CYP1A2CYP2C9CYP2C19MEN1KMT2A
SCHEMBL27212321 0.82 CYP1A2 (0.67) CYP1A2CYP2C9CYP2C19MEN1KMT2A
SCHEMBL31050100 0.74 AKR1C3 (0.46) MEN1KMT2AAKR1C3MAPTGAA
SCHEMBL23701855 0.74 AKR1C3 (0.46) MEN1KMT2AAKR1C3MAPTGAA
SCHEMBL23064291 0.74 AKR1C3 (0.46) MEN1KMT2AAKR1C3MAPTGAA

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-20250170116-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING AND/OR TREATING RENAL DISEASE OSAKA UNIVERSITY (JP) 2025-05-29 US disclosed
US-20250073229-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING AND/OR TREATING HEART FAILURE SHINSHU UNIVERSITY (JP) 2025-03-06 US disclosed
EP-4487848-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING AND/OR TREATING RENAL DISEASE OSAKA UNIVERSITY (JP) 2025-01-08 EP disclosed
EP-4461296-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING AND/OR TREATING HEART FAILURE Osaka University (JP) 2024-11-13 EP disclosed
CN-118678955-A Pharmaceutical composition for preventing and/or treating heart failure 国立大学法人大阪大学 2024-09-20 CN disclosed
US-20240307375-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING AND/OR TREATING KIDNEY INJURY, AND AUTOPHAGY ACTIVATOR KYOTO UNIVERSITY (JP) 2024-09-19 US disclosed
EP-4364739-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING AND/OR TREATING KIDNEY INJURY, AND AUTOPHAGY ACTIVATOR OSAKA UNIVERSITY (JP) 2024-05-08 EP disclosed
CN-117580577-A Pharmaceutical composition for preventing and/or treating kidney injury and autophagy activator 国立大学法人大阪大学 2024-02-20 CN 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 (3 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-20240307375-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING AND/OR TREATING KIDNEY INJURY, AND AUTOPHAGY ACTIVATOR ATG7, BECN1, SQSTM1 CYP1A2 366/4885CYP2C9 1103/4885CYP2C19 565/4885
US-20250170116-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING AND/OR TREATING RENAL DISEASE REN, ATP6V1B1, CYP2S1 CYP1A2 88/4885CYP2C9 65/4885CYP2C19 60/4885
US-20250073229-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING AND/OR TREATING HEART FAILURE CBR1, CYP2S1, CYP2F1 CYP1A2 87/4885CYP2C9 95/4885CYP2C19 84/4885

“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.