SCHEMBL16624341

SCHEMBL16624341

CN1CCc2c([nH]c3cc(F)ccc23)C1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.64
CHRNA7 P36544 1/20 0.49
DRD2 P14416 4/20 0.48
DRD1 P21728 4/20 0.48
DRD5 P21918 4/20 0.48
DRD3 P35462 4/20 0.48
DRD4 P21917 3/20 0.48
ADRA1A P35348 2/20 0.48
CYP1A2 P05177 2/20 0.48
CYP2D6 P10635 2/20 0.48
CYP2C9 P11712 2/20 0.48
MEN1 O00255 1/20 0.48
GMNN O75496 1/20 0.48
CYP3A4 P08684 1/20 0.48
ADRA1D P25100 1/20 0.48
CYP2C19 P33261 1/20 0.48
ADRA1B P35368 1/20 0.48
MTOR P42345 1/20 0.48
BLM P54132 1/20 0.48
PMP22 Q01453 1/20 0.48

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
SCHEMBL2185371 0.88 CHRNA7 (0.64) KDM4ECHRNA7DRD2DRD1DRD5
SCHEMBL18034943 0.88 KDM4E (0.64) KDM4ECHRNA7DRD2DRD1DRD5
SCHEMBL17993837 0.84 ADRA1A (0.45) KDM4EADRA1AMEN1KMT2AMMP1
SCHEMBL18034956 0.84 KDM4E (0.66) KDM4ECHRNA7DRD2DRD1DRD5
SCHEMBL3881136 0.82 KDM4E (0.64) KDM4ECHRNA7DRD2DRD1DRD5
SCHEMBL18035000 0.82 KDM4E (0.64) KDM4ECHRNA7DRD2DRD1DRD5
SCHEMBL20910234 0.82 KDM4E (0.64) KDM4ECHRNA7DRD2DRD1DRD5
SCHEMBL1120432 0.82 KDM4E (0.64) KDM4ECHRNA7DRD2DRD1DRD5
SCHEMBL21588326 0.82 KDM4E (0.44) KDM4EADRA1AL3MBTL1MMP1MMP14
SCHEMBL18034955 0.82 KDM4E (0.59) KDM4ECHRNA7DRD2DRD1DRD5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10744155-B2 Inhibitors of ADAMTS4 or ADAMTS5 for use in preventing or treating cardiac remodeling and chronic heart failure UNIVERSITETET I OSLO (NO) 2020-08-18 US disclosed
US-20190282606-A1 INHIBITORS OF ADAMTS4 OR ADAMTS5 FOR USE IN PREVENTING OR TREATING CARDIAC REMODELING AND CHRONIC HEART FAILURE UNIVERSITETET I OSLO (NO) 2019-09-19 US disclosed
US-20160237071-A1 T-TYPE CALCIUM CHANNEL INHIBITOR NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2016-08-18 US disclosed
US-20160158271-A1 INHIBITORS OF ADAMTS4 OR ADAMTS5 FOR USE IN PREVENTING OR TREATING CARDIAC REMODELING AND CHRONIC HEART FAILURE UNIVERSITETET I OSLO (NO) 2016-06-09 US disclosed
WO-2015050212-A1 T-TYPE CALCIUM CHANNEL BLOCKER 日産化学工業株式会社 2015-04-09 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 (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-20160237071-A1 T-TYPE CALCIUM CHANNEL INHIBITOR CACNA1I, CACNA1G, CACNA1H KDM4E 3594/4885CHRNA7 776/4885DRD2 935/4885
US-20190282606-A1 INHIBITORS OF ADAMTS4 OR ADAMTS5 FOR USE IN PREVENTING OR TREATING CARDIAC REMODELING AND CHRONIC HEART FAILURE ADAMTS5, ADAMTS4, ADAMTS1 KDM4E 440/4885CHRNA7 4387/4885DRD2 4808/4885
US-20160158271-A1 INHIBITORS OF ADAMTS4 OR ADAMTS5 FOR USE IN PREVENTING OR TREATING CARDIAC REMODELING AND CHRONIC HEART FAILURE ADAMTS5, ADAMTS4, ADAMTS1 KDM4E 440/4885CHRNA7 4387/4885DRD2 4808/4885
US-10744155-B2 Inhibitors of ADAMTS4 or ADAMTS5 for use in preventing or treating cardiac remodeling and chronic heart failure ADAMTS5, ADAMTS4, ADAMTS1 KDM4E 440/4885CHRNA7 4387/4885DRD2 4808/4885

“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.