SCHEMBL17809477

SCHEMBL17809477

C[C@H]1CN(C)CCN1c1ccc(Cl)cc1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.50
DRD4 P21917 1/20 0.50
MAPK1 P28482 1/20 0.43
ADAMTS5 Q9UNA0 5/20 0.42
MMP14 P50281 2/20 0.42
MMP2 P08253 2/20 0.42
LMNA P02545 2/20 0.40
MAPT P10636 3/20 0.39
ALDH1A1 P00352 1/20 0.39
ALOX12 P18054 1/20 0.39
MMP13 P45452 1/20 0.38
TP53 P04637 1/20 0.38
SLC6A3 Q01959 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
SCHEMBL14922270 1.00 DRD2 (0.50) DRD2DRD4MAPK1ADAMTS5MMP14
SCHEMBL17809480 1.00 DRD2 (0.50) DRD2DRD4MAPK1ADAMTS5MMP14
SCHEMBL27372185 0.84 SMN1; SMN2 (0.47) MAPK1LMNAMAPTALDH1A1TP53
SCHEMBL19003699 0.84 SMN1; SMN2 (0.47) MAPK1LMNAMAPTALDH1A1TP53
SCHEMBL2610122 0.84 SMN1; SMN2 (0.47) MAPK1LMNAMAPTALDH1A1TP53
SCHEMBL25839399 0.83 L3MBTL1 (0.41) DRD2DRD4MAPK1
SCHEMBL29310070 0.83 L3MBTL1 (0.41) DRD2DRD4MAPK1
SCHEMBL29310074 0.83 L3MBTL1 (0.41) DRD2DRD4MAPK1
SCHEMBL20884848 0.82 KDM4E (0.52) DRD2DRD4MAPK1LMNAMAPT
SCHEMBL5633573 0.82 ADAMTS5 (0.43) DRD2DRD4MAPK1ADAMTS5MMP2

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-10322143-B2 Inhibitors of ADAMTS4 or ADAMTS5 for use in preventing or treating cardiac remodeling and chronic heart failure UNIVERSITETET I OSLO (NO) 2019-06-18 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
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

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-10322143-B2 Inhibitors of ADAMTS4 or ADAMTS5 for use in preventing or treating cardiac remodeling and chronic heart failure ADAMTS5, ADAMTS4, ADAMTS1 DRD2 4808/4885DRD4 4648/4885MAPK1 3982/4885
US-20190282606-A1 INHIBITORS OF ADAMTS4 OR ADAMTS5 FOR USE IN PREVENTING OR TREATING CARDIAC REMODELING AND CHRONIC HEART FAILURE ADAMTS5, ADAMTS4, ADAMTS1 DRD2 4808/4885DRD4 4648/4885MAPK1 3982/4885
US-20160158271-A1 INHIBITORS OF ADAMTS4 OR ADAMTS5 FOR USE IN PREVENTING OR TREATING CARDIAC REMODELING AND CHRONIC HEART FAILURE ADAMTS5, ADAMTS4, ADAMTS1 DRD2 4808/4885DRD4 4648/4885MAPK1 3982/4885
US-10744155-B2 Inhibitors of ADAMTS4 or ADAMTS5 for use in preventing or treating cardiac remodeling and chronic heart failure ADAMTS5, ADAMTS4, ADAMTS1 DRD2 4808/4885DRD4 4648/4885MAPK1 3982/4885

“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.