SCHEMBL16620535

SCHEMBL16620535

Cn1c(I)cc2cccnc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 1/20 0.41
CDC7 O00311 1/20 0.39
CDK2 P24941 1/20 0.39
KDM4E B2RXH2 5/20 0.39
CYP3A4 P08684 3/20 0.39
CYP2D6 P10635 3/20 0.39
ATM Q13315 3/20 0.39
CYP1A2 P05177 2/20 0.39
CYP2C19 P33261 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
CCR1 P32246 2/20 0.38
CCR8 P51685 2/20 0.38
FEN1 P39748 1/20 0.37
ALDH1A1 P00352 4/20 0.36
DYRK1A Q13627 1/20 0.36
HTT P42858 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
GMNN O75496 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL8324162 0.78 CCR1 (0.43) AHRCDC7CDK2KDM4ECYP3A4
SCHEMBL29468208 0.77 AHR (0.47) AHRCDC7CDK2KDM4ECYP3A4
Ammonia Solution, Strong SCHEMBL28471192 0.77 CCR1 (0.42) AHRCDC7CDK2KDM4ECYP3A4
SCHEMBL28166205 0.77 KDM4E (0.42) AHRCDC7CDK2KDM4ECYP3A4
SCHEMBL19233651 0.77 CDC7 (0.46) AHRCDC7CDK2KDM4ECYP3A4
SCHEMBL31298631 0.77 KDM4E (0.42) AHRCDC7CDK2KDM4ECYP3A4
SCHEMBL10366831 0.76 CCNB2 (0.46) AHRCDC7CDK2KDM4ECYP3A4
SCHEMBL12724778 0.74 KDM4E (0.57) AHRCDC7CDK2KDM4ECYP3A4
SCHEMBL10218716 0.74 KDM4E (0.40) AHRCDC7CDK2KDM4ECYP3A4
SCHEMBL19841330 0.74 RORC (0.41) AHRCDC7CDK2KDM4ECYP3A4

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
WO-2025082069-A1 COMPOUND BINDING TO CRBN PROTEIN AND DEGRADATION AGENT OF PROTEIN 中国海洋大学 2025-04-24 WO disclosed
CN-119841843-A Compound combined with CRBN protein and degradation agent of CRBN protein 中国海洋大学 2025-04-18 CN disclosed
EP-3052501-B1 BICYCLIC ALKYNE DERIVATIVES AND USES THEREOF AGENCY SCIENCE TECH & RES (SG) 2022-06-22 EP disclosed
US-10544149-B2 Bicyclic alkyne derivatives and uses thereof AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2020-01-28 US disclosed
EP-3555094-A1 BICYCLIC OGA INHIBITOR COMPOUNDS Janssen Pharmaceutica NV (BE) 2019-10-23 EP disclosed
US-20180194771-A1 BICYCLIC ALKYNE DERIVATIVES AND USES THEREOF AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2018-07-12 US disclosed
WO-2018109198-A1 BICYCLIC OGA INHIBITOR COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2018-06-21 WO disclosed
US-9884867-B2 Bicyclic alkyne derivatives and uses thereof AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2018-02-06 US disclosed
US-20160229860-A1 BICYCLIC ALKYNE DERIVATIVES AND USES THEREOF AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2016-08-11 US disclosed
EP-3052501-A1 BICYCLIC ALKYNE DERIVATIVES AND USES THEREOF Agency For Science, Technology And Research (SG) 2016-08-10 EP disclosed
WO-2015050505-A1 BICYCLIC ALKYNE DERIVATIVES AND USES THEREOF AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2015-04-09 WO disclosed
CN-102584830-A Dihydroindene amide compounds, and medicinal composition and application thereof BEIJING SAILINTAI PHARMACEUTICAL TECHNOLOGY CO LTD 2012-07-18 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-20160229860-A1 BICYCLIC ALKYNE DERIVATIVES AND USES THEREOF MAPKAPK2, CAMKK2, MKNK2 AHR 818/4885CDC7 937/4885CDK2 219/4885
US-10544149-B2 Bicyclic alkyne derivatives and uses thereof MAPKAPK2, MAP4K2, MKNK2 AHR 766/4885CDC7 925/4885CDK2 217/4885
US-20180194771-A1 BICYCLIC ALKYNE DERIVATIVES AND USES THEREOF MAPKAPK2, CAMKK2, MKNK2 AHR 818/4885CDC7 937/4885CDK2 219/4885

“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.