Aniline

Aniline

SCHEMBL22169182

CC(C)Sc1ccccc1N.Nc1ccccc1

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.47
NPSR1 Q6W5P4 4/20 0.47
KMT2A Q03164 4/20 0.47
TDP1 Q9NUW8 4/20 0.47
KDM4E B2RXH2 2/20 0.47
MEN1 O00255 3/20 0.46
APOBEC3G Q9HC16 2/20 0.46
TSHR P16473 3/20 0.44
MAP2K1 Q02750 3/20 0.44
POLB P06746 1/20 0.42
MAPK1 P28482 2/20 0.41
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
SLC6A3 Q01959 1/20 0.36
CYP3A4 P08684 3/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
ALOX15 P16050 2/20 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
SCHEMBL1014289 0.92 MAPT (0.54) MAPTNPSR1KMT2ATDP1KDM4E
Hydrochloric Acid SCHEMBL19896479 0.90 MAPT (0.52) MAPTNPSR1KMT2ATDP1KDM4E
SCHEMBL17879577 0.79 MAPT (0.50) MAPTNPSR1KMT2ATDP1KDM4E
SCHEMBL540557 0.79 MAPT (0.54) MAPTNPSR1KMT2ATDP1KDM4E
Aniline SCHEMBL22169215 0.77 KMT2A (0.52) MAPTNPSR1KMT2ATDP1KDM4E
SCHEMBL30548758 0.75 MAP2K7 (0.41) MAPTNPSR1KMT2ATDP1KDM4E
SCHEMBL11375178 0.73 MAPT (0.48) MAPTNPSR1KMT2ATDP1KDM4E
Aniline SCHEMBL22169134 0.73 POLB (0.53) MAPTNPSR1KMT2ATDP1KDM4E
SCHEMBL10589041 0.73 NPSR1 (0.49) MAPTNPSR1KMT2ATDP1KDM4E
Aniline SCHEMBL6154453 0.72 TSHR (0.73) MAPTKMT2ATDP1KDM4EMEN1

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-10703746-B2 Mutant IDH1 inhibitors useful for treating cancer THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2020-07-07 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-10703746-B2 Mutant IDH1 inhibitors useful for treating cancer IDH1, IDH3B, IDH3A MAPT 4568/4885NPSR1 4813/4885KMT2A 221/4885

“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.