SCHEMBL16474359

SCHEMBL16474359

CCN1CC(F)(F)CC1c1cccc(F)c1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 3/20 0.46
RCOR1 Q9UKL0 1/20 0.46
NTRK1 P04629 2/20 0.41
JAK2 O60674 1/20 0.41
MAOB P27338 3/20 0.39
MAOA P21397 2/20 0.39
RIPK1 Q13546 3/20 0.39
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
HTR2A P28223 2/20 0.38
HTR2C P28335 2/20 0.38
HTR2B P41595 2/20 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
SCHEMBL17772171 0.87 KDM1A (0.47) KDM1ARCOR1MAOBMAOARIPK1
SCHEMBL18324650 0.81 KDM1A (0.42) KDM1ARCOR1NTRK1JAK2MAOB
SCHEMBL4289056 0.81 MAOB (0.45) KDM1ARCOR1NTRK1JAK2MAOB
SCHEMBL4096537 0.78 KDM1A (0.40) KDM1ARCOR1NTRK1JAK2MAOB
SCHEMBL454721 0.77 NTRK1 (0.43) KDM1ARCOR1NTRK1JAK2MAOB
SCHEMBL454720 0.77 NTRK1 (0.43) KDM1ARCOR1NTRK1JAK2MAOB
SCHEMBL17772162 0.76 RIPK1 (0.50) KDM1ARCOR1MAOBMAOARIPK1
SCHEMBL19275745 0.74 RIPK1 (0.58) MAOBMAOARIPK1KDM4E
SCHEMBL25315864 0.73 RIPK1 (0.45) KDM1ARCOR1NTRK1JAK2MAOB
SCHEMBL18783105 0.72 LMNA (0.56) KDM1ARCOR1NTRK1MAOBMAOA

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-10011604-B2 Method of treatment using substituted imidazo[1,2b]pyridazine compounds ARRAY BIOPHARMA, INC. (US) 2018-07-03 US disclosed
US-9682979-B2 Substituted pyrazolo [1,5-A] pyrimidine compounds as TRK kinase inhibitors ARRAY BIOPHARMA, INC. (US) 2017-06-20 US 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-10011604-B2 Method of treatment using substituted imidazo[1,2b]pyridazine compounds COL2A1, COL1A1, IFNAR1 KDM1A 967/4885RCOR1 2900/4885NTRK1 466/4885

“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.