SCHEMBL16474197

SCHEMBL16474197

CCN1C(c2cccc(F)c2)CCC1(C)C

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.46
RCOR1 Q9UKL0 1/20 0.46
RIPK1 Q13546 3/20 0.44
MAOB P27338 2/20 0.42
MAOA P21397 1/20 0.42
TDP1 Q9NUW8 1/20 0.38
KDM4E B2RXH2 2/20 0.38
NOS3 P29474 1/20 0.37
ALDH1A1 P00352 2/20 0.36
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
HTR2B P41595 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
GRM5 P41594 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
SCHEMBL4297771 0.81 MAOB (0.45) KDM1ARCOR1RIPK1MAOBMAOA
SCHEMBL18812548 0.77 NTRK1 (0.43) KDM1ARIPK1L3MBTL1
SCHEMBL4096511 0.77 RIPK1 (0.40) KDM1ARCOR1RIPK1MAOBMAOA
SCHEMBL17772162 0.73 RIPK1 (0.50) KDM1ARCOR1RIPK1MAOBMAOA
SCHEMBL17772171 0.72 KDM1A (0.47) KDM1ARCOR1RIPK1MAOBMAOA
SCHEMBL19275745 0.71 RIPK1 (0.58) RIPK1MAOBMAOAKDM4E
SCHEMBL18783105 0.70 LMNA (0.56) KDM1ARCOR1RIPK1MAOBMAOA
SCHEMBL11628492 0.69 MAOB (0.55) KDM1ARIPK1MAOBMAOAHTR2A
SCHEMBL16474359 0.69 KDM1A (0.46) KDM1ARCOR1RIPK1MAOBMAOA
Iodide SCHEMBL11625219 0.68 MAOB (0.54) KDM1ARIPK1MAOBMAOAHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170112849-A1 Method of Treatment Using Substituted Imidazo[1,2b]Pyridazine Compounds ARRAY BIOPHARMA, INC. 2017-04-27 US disclosed
EP-3106463-A1 SUBSTITUTED PYRAZOLO[1,5-]PYRIMIDINE COMPOUNDS AS TRK KINASE INHIBITORS Array Biopharma, Inc. (US) 2016-12-21 EP disclosed
EP-2350071-B1 SUBSTITUTED PYRAZOLO[1,5-a]PYRIMIDINE COMPOUNDS AS TRK KINASE INHIBITORS ARRAY BIOPHARMA INC (US) 2014-01-08 EP 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-20170112849-A1 Method of Treatment Using Substituted Imidazo[1,2b]Pyridazine Compounds COL2A1, COL1A1, IFNAR1 KDM1A 967/4885RCOR1 2900/4885RIPK1 4526/4885

“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.