SCHEMBL6835159

SCHEMBL6835159

Cn1ccc2cc(C3(N)N=C(NCc4ccccn4)C=CN3)ccc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 2/20 0.43
PTK2B Q14289 1/20 0.43
ATAD2 Q6PL18 1/20 0.39
KDM4E B2RXH2 7/20 0.35
ALDH1A1 P00352 7/20 0.35
NPC1 O15118 4/20 0.35
RAB9A P51151 4/20 0.35
ALOX15 P16050 2/20 0.35
HTT P42858 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
MAPT P10636 2/20 0.35
TP53 P04637 1/20 0.35
PKM P14618 1/20 0.35
CYP2D6 P10635 1/20 0.35
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
KCNH2 Q12809 1/20 0.35
GAA P10253 3/20 0.34
NPSR1 Q6W5P4 1/20 0.34

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
SCHEMBL985148 0.66 SLC6A2 (0.73) PTK2PTK2BCYP2D6SLC6A2SLC6A4
SCHEMBL6209489 0.65 PTK2 (0.66) PTK2PTK2BATAD2KDM4EALDH1A1
SCHEMBL6211452 0.62 PTK2 (0.75) PTK2PTK2BGRM4
SCHEMBL6216143 0.62 PTK2 (0.75) PTK2PTK2BKDM4ENPC1RAB9A
SCHEMBL982085 0.61 SLC6A2 (0.52) PTK2PTK2BKDM4EALDH1A1CYP2D6
SCHEMBL6211140 0.61 PTK2 (1.00) PTK2PTK2B
SCHEMBL31617134 0.60 MAOA (0.46) KDM4EALDH1A1NPC1RAB9AHTT
SCHEMBL1171736 0.59 KDM4E (0.48) KDM4EALDH1A1SMN1; SMN2MAPTCYP2D6
SCHEMBL20605038 0.58 TGFBR1 (0.60) MAPTFAAHMAOB
SCHEMBL28503979 0.57 HRH1 (0.39) KDM4EALDH1A1SMN1; SMN2MAPTTP53

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-20040220177-A1 Compound for the treatment of abnormal cell growth PFIZER INC 2004-11-04 US claimed
US-20040220177-A1 Compound for the treatment of abnormal cell growth PFIZER INC 2004-11-04 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-20040220177-A1 Compound for the treatment of abnormal cell growth CCNA1, CCNB1, CCNT1 PTK2 3004/4885PTK2B 1941/4885ATAD2 4364/4885

“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.