SCHEMBL6833346

SCHEMBL6833346

Clc1ccc(CCNc2nc(Cl)ncc2Br)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STK17B O94768 1/20 0.48
STK17A Q9UEE5 1/20 0.48
IGF1R P08069 1/20 0.47
HTT P42858 5/20 0.47
TTBK1 Q5TCY1 1/20 0.46
TTBK2 Q6IQ55 1/20 0.46
HDAC3 O15379 1/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC2 Q92769 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
LMNA P02545 2/20 0.45
TSHR P16473 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HSD17B10 Q99714 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
APP P05067 1/20 0.43
TAAR1 Q96RJ0 1/20 0.41
ALDH1A1 P00352 2/20 0.41

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
SCHEMBL653889 0.89 APP (0.42) STK17BSTK17AIGF1RHTTMEN1
SCHEMBL6213464 0.89 GALR3 (0.51) STK17BSTK17AIGF1RMEN1KMT2A
SCHEMBL6209927 0.88 APP (0.57) IGF1RHTTHDAC3HDAC1HDAC2
SCHEMBL13310307 0.87 MKNK2 (0.48) STK17BSTK17AIGF1RMEN1KMT2A
SCHEMBL6211283 0.86 APP (0.49) IGF1RHTTMEN1KMT2ALMNA
Hydrochloric Acid SCHEMBL3450039 0.86 MKNK2 (0.47) STK17BSTK17AIGF1RMEN1KMT2A
SCHEMBL6274026 0.85 IGF1R (0.48) IGF1RHTTMEN1KMT2ALMNA
SCHEMBL6832398 0.83 IGF1R (0.52) IGF1RHDAC3HDAC1HDAC2HDAC6
SCHEMBL3447541 0.81 IGF1R (0.51) IGF1RL3MBTL1APP
SCHEMBL6212947 0.80 APP (0.48) STK17BSTK17AIGF1RLMNATSHR

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 1 patent. 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 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 STK17B 2945/4885STK17A 3078/4885IGF1R 93/4885

“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.