SCHEMBL20564672

SCHEMBL20564672

O=c1[nH]c(Cc2cc(F)cc(F)c2)nc2ccccc12

nearest known ligand 0.73

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.73
TNKS2 Q9H2K2 3/20 0.57
KDM4E B2RXH2 2/20 0.57
LMNA P02545 2/20 0.57
MAPT P10636 1/20 0.57
SMN1; SMN2 Q16637 3/20 0.56
PDE10A Q9Y233 3/20 0.54
MAOB P27338 2/20 0.53
PARP1 P09874 3/20 0.52
PARP2 Q9UGN5 2/20 0.52
RAB9A P51151 1/20 0.52
ALDH1A1 P00352 1/20 0.52
POLB P06746 1/20 0.51
TNKS O95271 1/20 0.50

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
SCHEMBL9178009 0.85 KMT2A (1.00) KMT2ATNKS2KDM4ELMNAMAPT
SCHEMBL31717037 0.80 KMT2A (0.64) KMT2ATNKS2KDM4ELMNAMAPT
SCHEMBL27902884 0.79 GAA (0.68) LMNAMAPTRAB9APOLB
SCHEMBL31338440 0.79 KMT2A (0.76) KMT2ATNKS2KDM4ELMNAMAPT
SCHEMBL28957724 0.78 KMT2A (0.80) KMT2ATNKS2KDM4ELMNAMAPT
SCHEMBL31716910 0.78 KMT2A (0.80) KMT2ATNKS2KDM4ELMNAMAPT
SCHEMBL4099549 0.78 KMT2A (0.74) KMT2ATNKS2KDM4ELMNAMAPT
SCHEMBL16144822 0.77 KMT2A (0.73) KMT2ATNKS2KDM4ELMNAMAPT
SCHEMBL28206029 0.77 PDE10A (0.67) KMT2ATNKS2LMNASMN1; SMN2PDE10A
SCHEMBL2260560 0.77 TNKS2 (0.70) KMT2ATNKS2KDM4ELMNAMAPT

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-11318137-B2 Quinazoline compounds as modulators of Ras signaling VANDERBILT UNIVERSITY (US) 2022-05-03 US disclosed
US-20200253974-A1 QUINAZOLINE COMPOUNDS AS MODULATORS OF RAS SIGNALING VANDERBILT UNIVERSITY 2020-08-13 US disclosed
WO-2018212774-A1 QUINAZOLINE COMPOUNDS AS MODULATORS OF RAS SIGNALING VANDERBILT UNIVERSITY (US) 2018-11-22 WO 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 (2 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-20200253974-A1 QUINAZOLINE COMPOUNDS AS MODULATORS OF RAS SIGNALING NRAS, KRAS, MAVS KMT2A 3348/4885TNKS2 1341/4885KDM4E 3713/4885
US-11318137-B2 Quinazoline compounds as modulators of Ras signaling NRAS, KRAS, MAVS KMT2A 3348/4885TNKS2 1341/4885KDM4E 3713/4885

“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.