SCHEMBL4814749

SCHEMBL4814749

C#CCNc1cc(F)ccc1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.44
MAPT P10636 4/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
TDP1 Q9NUW8 1/20 0.43
MAPK1 P28482 1/20 0.40
DHFR P00374 1/20 0.39
TSHR P16473 2/20 0.38
CYP3A4 P08684 1/20 0.38
RECQL P46063 1/20 0.38
HPGD P15428 2/20 0.38
LMNA P02545 1/20 0.38
HTT P42858 2/20 0.37
POLB P06746 2/20 0.35
KDM4E B2RXH2 1/20 0.35
NR2F2 P24468 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CA12 O43570 1/20 0.35
CA4 P22748 1/20 0.35
CA9 Q16790 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
SCHEMBL1643707 0.79 CYP3A4 (0.60) ALDH1A1MAPTMEN1KMT2ATDP1
SCHEMBL24869074 0.77 RECQL (0.38) TSHRCYP3A4RECQL
SCHEMBL16502278 0.77 ALDH1A1 (0.54) ALDH1A1MAPTMEN1KMT2ATDP1
SCHEMBL28185989 0.76 KMT2A (0.40) MAPTMEN1KMT2ATDP1MAPK1
SCHEMBL8693896 0.76 HDAC1 (0.42) ALDH1A1MAPTHPGDHTTKDM4E
SCHEMBL17845271 0.74 MAPT (0.44) ALDH1A1MAPTMEN1KMT2ATDP1
SCHEMBL18622661 0.74 FERMT2 (0.50) ALDH1A1MAPTMEN1KMT2ATDP1
SCHEMBL16507797 0.73 MAPT (0.47) ALDH1A1MAPTMEN1KMT2ATDP1
SCHEMBL21318163 0.73 MAPT (0.43) ALDH1A1MAPTMEN1KMT2ATDP1
SCHEMBL5982504 0.72 MAPT (0.61) ALDH1A1MAPTMEN1KMT2ATDP1

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
EP-1740579-B1 TRICYCLIC PYRAZOLE KINASE INHIBITORS ABBVIE INC (US) 2015-08-19 EP disclosed
US-7468371-B2 Tricyclic pyrazole kinase inhibitors ABBOTT LABORATORIES INC. (US) 2008-12-23 US disclosed
US-20060014816-A1 Tricyclic pyrazole kinase inhibitors ABBVIE INC. 2006-01-19 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-20060014816-A1 Tricyclic pyrazole kinase inhibitors PRKDC, PRKACA, PIK3C3 ALDH1A1 3901/4885MAPT 2427/4885MEN1 3383/4885

“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.