SCHEMBL14915770

SCHEMBL14915770

CNC(=O)c1ccc(I)cc1F

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.56
MAP2K1 Q02750 10/20 0.53
MAP2K2 P36507 6/20 0.53
GPR27 Q9NS67 1/20 0.47
PIM1 P11309 1/20 0.41
CAMK2B Q13554 1/20 0.41
AKR1B1 P15121 1/20 0.40
KDM4E B2RXH2 1/20 0.40
HTT P42858 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
HDAC1 Q13547 1/20 0.39
ALDH1A1 P00352 1/20 0.39

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
SCHEMBL1477061 0.85 GAA (0.56) GAAMAP2K1MAP2K2PIM1CAMK2B
SCHEMBL909599 0.81 CES2 (0.61) GAAGPR27KDM4EHDAC1ALDH1A1
SCHEMBL17993972 0.81 ALDH1A1 (0.46) GAAMAP2K1MAP2K2GPR27PIM1
Hydrochloric Acid SCHEMBL29775858 0.79 CES2 (0.59) GAAGPR27KDM4EHDAC1ALDH1A1
SCHEMBL12678697 0.79 GAA (0.58) GAAKDM4EHTTRXFP1ALDH1A1
SCHEMBL29306646 0.79 GAA (0.58) GAAKDM4EHTTRXFP1HDAC1
SCHEMBL1003542 0.79 GAA (0.58) GAAKDM4EHTTRXFP1HDAC1
SCHEMBL22226016 0.79 MAP2K1 (0.42) GAAMAP2K1MAP2K2HTT
SCHEMBL1350827 0.79 MAOB (0.45) MAP2K1MAP2K2GPR27
SCHEMBL17958307 0.78 MAP2K1 (0.74) MAP2K1MAP2K2PIM1CAMK2BHDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4743453-A1 MODULATORS OF MITOCHONDRIAL DNA REPLICATION Pretzel Therapeutics, Inc. (US) 2026-05-20 EP disclosed
US-20250325542-A1 INHIBITORS OF ANTIMOCROBIAL RESISTANCE AND METHOS USING SAME BAYLOR COLLEGE MEDICINE (US) 2025-10-23 US disclosed
WO-2025015178-A1 MODULATORS OF MITOCHONDRIAL DNA REPLICATION PRETZEL THERAPEUTICS, INC. (US) 2025-01-16 WO disclosed
WO-2023250467-A2 INHIBITORS OF ANTIMICROBIAL RESISTANCE AND METHODS USING SAME BAYLOR COLLEGE OF MEDICINE (US) 2023-12-28 WO disclosed
EP-3660016-A1 N-(1-(SUBSTITUTED-PHENYL)ETHYL)-9H-PURIN-6-AMINES AS PI3K INHIBITORS Incyte Holdings Corporation (US) 2020-06-03 EP disclosed
EP-2655374-B1 N-(1-(SUBSTITUTED-PHENYL)ETHYL)-9H-PURIN-6-AMINES AS PI3K INHIBITORS INCYTE HOLDINGS CORP (US) 2019-10-23 EP disclosed
EP-2767531-B1 Cyclic n,n'-diarylthioureas and n,n'-diarylureas as androgen receptor antagonists, anti-cancer agent, method for producing and using same IVACHTCHENKO ALEXANDRE VASILIEVICH (US) 2016-12-21 EP disclosed
EP-2718279-B1 NOVEL COMPOUNDS AS MODULATORS OF GPR-119 RHIZEN PHARMACEUTICALS SA (CH) 2016-08-10 EP disclosed
US-9085539-B2 Cyclic N,N′-diarylthiourea—androgen receptor antagonist, anti breast cancer composition and use thereof R-PHARM OVERSEAS INC. 2015-07-21 US disclosed
US-9073874-B2 Cyclic N,N′-diarylthioureas and N,N′-diarylureas-androgen receptor antagonists, anticancer agent, method for preparation and use thereof R-PHARM OVERSEAS INC. 2015-07-07 US disclosed
US-9073874-B2 Cyclic N,N′-diarylthioureas and N,N′-diarylureas-androgen receptor antagonists, anticancer agent, method for preparation and use thereof R-PHARM OVERSEAS INC. 2015-07-07 US disclosed
US-20140329858-A1 Cyclic Urea Derivatives As Androgen Receptor Antagonists NOVARTIS AG (CH) 2014-11-06 US disclosed
US-20140329858-A1 Cyclic Urea Derivatives As Androgen Receptor Antagonists NOVARTIS AG (CH) 2014-11-06 US disclosed
US-20140329858-A1 Cyclic Urea Derivatives As Androgen Receptor Antagonists NOVARTIS AG (CH) 2014-11-06 US disclosed
EP-2767531-A1 Cyclic n,n'-diarylthioureas and n,n'-diarylureas as androgen receptor antagonists, anti-cancer agent, method for producing and using same Ivachtchenko, Alexandre Vasilievich (US) 2014-08-20 EP disclosed
US-20130252992-A1 CYCLIC N,N'-DIARYLTHIOUREA - ANDROGEN RECEPTOR ANTAGONIST, ANTI BREAST CANCER COMPOSITION AND USE THEREOF R-PHARM OVERSEAS INC. 2013-09-26 US disclosed
WO-2013084138-A1 CYCLIC UREA DERIVATIVES AS ANDROGEN RECEPTOR ANTAGONISTS NOVARTIS AG (CH) 2013-06-13 WO disclosed
EP-2597086-A1 CYCLIC N,N'-DIARYLTHIOUREAS AND N,N'-DIARYLUREAS AS ANDROGEN RECEPTOR ANTAGONISTS, ANTI-CANCER AGENT, METHOD FOR PRODUCING AND USING SAME Ivachtchenko, Alexandre Vasilievich (RU) 2013-05-29 EP disclosed
US-20130116269-A1 CYCLIC N,N'-DIARYLTHIOUREAS AND N,N'-DIARYLUREAS - ANDROGEN RECEPTOR ANTAGONISTS, ANTICANCER AGENT, METHOD FOR PREPARATION AND USE THEREOF R-PHARM OVERSEAS INC. 2013-05-09 US 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-20140329858-A1 Cyclic Urea Derivatives As Androgen Receptor Antagonists AR, UTS2R, FSHR GAA 4554/4885MAP2K1 4105/4885MAP2K2 3735/4885
US-20130116269-A1 CYCLIC N,N'-DIARYLTHIOUREAS AND N,N'-DIARYLUREAS - ANDROGEN RECEPTOR ANTAGONISTS, ANTICANCER AGENT, METHOD FOR PREPARATION AND USE THEREOF AR, NR5A1, GNRHR GAA 4877/4885MAP2K1 4322/4885MAP2K2 4299/4885
US-20250325542-A1 INHIBITORS OF ANTIMOCROBIAL RESISTANCE AND METHOS USING SAME BPGM, PNMT, DDT GAA 294/4885MAP2K1 3977/4885MAP2K2 3723/4885
US-20130252992-A1 CYCLIC N,N'-DIARYLTHIOUREA - ANDROGEN RECEPTOR ANTAGONIST, ANTI BREAST CANCER COMPOSITION AND USE THEREOF AR, NR5A1, CYP19A1 GAA 4880/4885MAP2K1 3719/4885MAP2K2 3725/4885

“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.