SCHEMBL22957672

SCHEMBL22957672

CC(C)(C)NCc1ccccc1OCC1CCCC1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RIPK1 Q13546 1/20 0.60
▸ HTT P42858 1/20 0.49
▸ NPY1R P25929 1/20 0.44
▸ NPY2R P49146 1/20 0.44
▸ HTR2C P28335 2/20 0.43
▸ CYP1A2 P05177 2/20 0.42
▸ CYP2D6 P10635 2/20 0.42
▸ ADRA1A P35348 2/20 0.42
▸ USP2 O75604 1/20 0.42
▸ HTR1A P08908 1/20 0.42
▸ ADRA2A P08913 1/20 0.42
▸ CHRM1 P11229 1/20 0.42
▸ CYP2C9 P11712 1/20 0.42
▸ DRD1 P21728 1/20 0.42
▸ TBXA2R P21731 1/20 0.42
▸ PTGS1 P23219 1/20 0.42
▸ SLC6A2 P23975 1/20 0.42
▸ SLC6A4 P31645 1/20 0.42
▸ OPRM1 P35372 1/20 0.42
▸ DRD3 P35462 1/20 0.42

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
SCHEMBL22957816 0.97 RIPK1 (0.60) RIPK1HTTNPY1RNPY2RHTR2C
SCHEMBL22957658 0.94 RIPK1 (0.68) RIPK1HTTNPY1RNPY2RHTR2C
SCHEMBL22957766 0.85 RIPK1 (0.55) RIPK1HTR2CSLC6A2SLC6A4KCNH2
SCHEMBL22957805 0.84 RIPK1 (0.54) RIPK1HTR2CSLC6A2SLC6A4KCNH2
SCHEMBL22957853 0.83 NPY1R (0.49) RIPK1HTTNPY1RNPY2RHTR2C
SCHEMBL22957661 0.83 RIPK1 (0.61) RIPK1HTTHTR2CCYP1A2CYP2D6
SCHEMBL24018785 0.82 RIPK1 (0.51) RIPK1HTR2CSLC6A2SLC6A4KCNH2
SCHEMBL22390530 0.82 RIPK1 (0.88) RIPK1HTR2CCYP1A2CYP2D6ADRA1A
SCHEMBL22957773 0.82 RIPK1 (0.55) RIPK1HTR2CSLC6A2SLC6A4KCNH2
SCHEMBL22957804 0.81 RIPK1 (0.51) RIPK1MCHR1FAAHCNR1CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10913738-B2 Aminotriazolopyridines as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2021-02-09 — — 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 (1 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-10913738-B2 Aminotriazolopyridines as kinase inhibitors RIPK1, RIPK3, RIPK4 RIPK1 1/4885HTT 4152/4885NPY1R 2919/4885

“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.

Send feedback