SCHEMBL6986640

SCHEMBL6986640

CN1CCC[C@@H](Cc2ccc(F)cc2)C1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 5/20 0.47
KCNH2 Q12809 2/20 0.47
CHRM1 P11229 2/20 0.47
HRH1 P35367 2/20 0.47
CARM1 Q86X55 1/20 0.47
PRMT6 Q96LA8 1/20 0.47
CCR3 P51677 4/20 0.46
MAOB P27338 1/20 0.45

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
SCHEMBL12090432 1.00 CYP2D6 (0.47) CYP2D6KCNH2CHRM1HRH1CARM1
SCHEMBL21216506 1.00 CYP2D6 (0.47) CYP2D6KCNH2CHRM1HRH1CARM1
SCHEMBL19993075 0.92 NR1D2 (0.49) CYP2D6KCNH2CHRM1HRH1
SCHEMBL12090378 0.85 CARM1 (0.48) CYP2D6KCNH2CHRM1HRH1CARM1
SCHEMBL21216508 0.83 LSS (0.55) CARM1PRMT6
SCHEMBL2606112 0.83 CARM1 (0.64) CYP2D6KCNH2CHRM1HRH1CARM1
SCHEMBL6986639 0.82 CCR3 (0.44) CYP2D6CCR3MAOB
SCHEMBL22623996 0.81 CCR3 (0.42) CYP2D6CARM1PRMT6CCR3MAOB
SCHEMBL22623880 0.81 CCR3 (0.42) CYP2D6CARM1PRMT6CCR3MAOB
SCHEMBL22623954 0.81 CCR3 (0.42) CYP2D6CARM1PRMT6CCR3MAOB

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-20230312697-A1 METHODS OF IMPROVING RETINA-ASSOCIATED DISEASE OUTCOME USING CCR3-INHIBITORS ALKAHEST INC. 2023-10-05 US disclosed
EP-3743430-B1 AMINOPYRROLOTRIAZINES AS KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2023-08-02 EP disclosed
EP-3580220-B1 AMINOTRIAZOLOPYRIDINES AS KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2021-11-17 EP disclosed
US-10913738-B2 Aminotriazolopyridines as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2021-02-09 US disclosed
US-20200347071-A1 AMINOPYRROLOTRIAZINES AS KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2020-11-05 US disclosed
WO-2019147782-A1 AMINOPYRROLOTRIAZINES AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2019-08-01 WO disclosed
EP-1296978-A2 N-UREIDOHETEROCYCLOAKLYL-PIPERIDINES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY BRISTOL-MYERS SQUIBB COMPANY (US) 2003-04-02 EP disclosed
WO-2002002525-A2 N-UREIDOHETEROCYCLOAKLYL-PIPERIDINES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2002-01-10 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 (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-20200347071-A1 AMINOPYRROLOTRIAZINES AS KINASE INHIBITORS RIPK1, RIPK2, RIPK4 CYP2D6 3602/4885KCNH2 1935/4885CHRM1 3837/4885
US-20230312697-A1 METHODS OF IMPROVING RETINA-ASSOCIATED DISEASE OUTCOME USING CCR3-INHIBITORS CCR3, CCR1, CCRL2 CYP2D6 4561/4885KCNH2 4649/4885CHRM1 2979/4885
US-10913738-B2 Aminotriazolopyridines as kinase inhibitors RIPK1, RIPK3, RIPK4 CYP2D6 1818/4885KCNH2 1920/4885CHRM1 3581/4885

“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.