SCHEMBL24349352

SCHEMBL24349352

CC1(C)c2cccnc2-c2c1ccc1ccccc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.42
KMT2A Q03164 5/20 0.38
MAPT P10636 5/20 0.38
KDM4E B2RXH2 5/20 0.38
MEN1 O00255 4/20 0.38
TDP1 Q9NUW8 4/20 0.38
ALDH1A1 P00352 3/20 0.38
THRB P10828 2/20 0.38
RECQL P46063 2/20 0.38
NPC1 O15118 1/20 0.38
POLB P06746 1/20 0.38
RAB9A P51151 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CYP2A6 P11509 2/20 0.36
PDK2 Q15119 3/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C19 P33261 1/20 0.35
LMNA P02545 3/20 0.34
MAPK1 P28482 1/20 0.34
TSHR P16473 2/20 0.33

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
SCHEMBL26710488 0.85 CYP3A4 (0.36) CYP3A4KMT2AMAPTKDM4EMEN1
SCHEMBL16547409 0.81 KDM4E (0.38) CYP3A4KMT2AMAPTKDM4EMEN1
SCHEMBL24349338 0.81 KMT2A (0.40) CYP3A4KMT2AMAPTKDM4EMEN1
SCHEMBL26710502 0.79 KMT2A (0.37) CYP3A4KMT2AMAPTKDM4EMEN1
SCHEMBL2539931 0.79 CYP2A6 (0.48) CYP3A4KMT2AMAPTKDM4EMEN1
SCHEMBL10000562 0.78 PDK2 (0.39) CYP3A4KMT2AMAPTKDM4EMEN1
SCHEMBL24349350 0.77 KMT2A (0.42) CYP3A4KMT2AMAPTKDM4EMEN1
SCHEMBL10000559 0.77 PDK2 (0.38) CYP3A4KMT2AMAPTKDM4EMEN1
SCHEMBL24349361 0.76 CYP3A4 (0.39) CYP3A4KMT2AMAPTKDM4EMEN1
SCHEMBL12952457 0.76 HTR2B (0.37) CYP3A4KMT2AMAPTKDM4EALDH1A1

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-20220081510-A1 THERMOPLASTIC RESIN, OPTICAL FILM MADE THEREFROM, DIOL COMPOUND, DIESTER COMPOUND MITSUBISHI CHEMICAL CORPORATION (JP) 2022-03-17 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-20220081510-A1 THERMOPLASTIC RESIN, OPTICAL FILM MADE THEREFROM, DIOL COMPOUND, DIESTER COMPOUND RTF1, RNF10, RAD51 CYP3A4 1431/4885KMT2A 525/4885MAPT 1644/4885

“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.