SCHEMBL19010281

SCHEMBL19010281

CC(=O)c1nnc(Nc2ccc(N3CCNCC3)cc2)cc1NCC(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 2/20 0.47
CDK4 P11802 10/20 0.40
CCNA2 P20248 7/20 0.40
CDK2 P24941 7/20 0.40
CCND1 P24385 7/20 0.40
FGFR1 P11362 3/20 0.40
FGFR2 P21802 3/20 0.40
FGFR4 P22455 3/20 0.40
FGFR3 P22607 3/20 0.40
CCND3 P30281 6/20 0.39
CCNT1 O60563 1/20 0.39
CDK1 P06493 1/20 0.39
CCNB1 P14635 1/20 0.39
CDK7 P50613 1/20 0.39
CDK9 P50750 1/20 0.39
CCNH P51946 1/20 0.39
CTSL P07711 3/20 0.39
CTSB P07858 3/20 0.39
CTSS P25774 3/20 0.39
BPTF Q12830 2/20 0.39

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
SCHEMBL17021309 0.91 HRH4 (0.46) HRH4CDK4CCNA2CDK2CCND1
SCHEMBL19010245 0.88 MAPT (0.46) BPTFALDH1A1
SCHEMBL19010246 0.87 CDK4 (0.43) CDK4CCNA2CDK2CCND1FGFR1
SCHEMBL19010284 0.85 CDK4 (0.44) HRH4CDK4CCNA2CDK2CCND1
SCHEMBL19010256 0.82 MAPT (0.51) CDK4CCNA2CDK2CCND1FGFR1
SCHEMBL17021304 0.81 SYK (0.47) BPTF
SCHEMBL19010244 0.80 FLT3 (0.49) HRH4CDK4CCNA2CDK2CCND1
SCHEMBL17021323 0.80 MAPT (0.44) BPTFALDH1A1
SCHEMBL19010263 0.80 FLT3 (0.48) HRH4CDK4CCNA2CDK2CCND1
SCHEMBL17021324 0.78 LRRK2 (0.46) CDK4CCNA2CDK2CCND1FGFR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9834548-B2 Pyridazine compounds as JAK inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2017-12-05 US disclosed
US-20170174673-A1 PYRIDAZINE COMPOUNDS AS JAK INHIBITORS ALEXION PHARMACEUTICALS, INC. 2017-06-22 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-20170174673-A1 PYRIDAZINE COMPOUNDS AS JAK INHIBITORS JAK1, JAK2, JAK3 HRH4 683/4885CDK4 163/4885CCNA2 1934/4885

“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.