SCHEMBL18158063

SCHEMBL18158063

COc1ccc(C(C)(C)C)cc1NC(Cc1ccccn1)c1ccccn1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
ALDH1A1 P00352 7/20 0.39
HPGD P15428 3/20 0.39
KDM4E B2RXH2 2/20 0.39
MAPT P10636 2/20 0.39
RECQL P46063 1/20 0.39
PKM P14618 1/20 0.39
POLB P06746 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
HTT P42858 1/20 0.39
MAPK14 Q16539 1/20 0.38
ALOX15 P16050 2/20 0.38
RAB9A P51151 3/20 0.37
NPC1 O15118 2/20 0.37
GAA P10253 1/20 0.37
HSD17B10 Q99714 1/20 0.37

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
SCHEMBL19214729 0.83 KMT2A (0.43) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL18157970 0.79 CYP3A4 (0.42) MEN1KMT2AALDH1A1POLBNPSR1
SCHEMBL20024585 0.78 ALDH1A1 (0.55) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL18157968 0.70 FDPS (0.41) KMT2AALDH1A1HPGDKDM4ERAB9A
SCHEMBL1713198 0.69 SYK (0.41) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL18158015 0.69 SCN8A (0.41) ALDH1A1POLBALOX15RAB9ANPC1
SCHEMBL15701533 0.68 MRGPRX4 (0.52) ALDH1A1KDM4EMAPTRECQLNPSR1
SCHEMBL12261881 0.66 SYK (0.53) ALDH1A1KDM4ERAB9ANPC1GAA
SCHEMBL15784737 0.66 ALDH1A1 (0.48) MEN1KMT2AALDH1A1KDM4EPOLB
SCHEMBL15784696 0.66 ALDH1A1 (0.48) MEN1KMT2AALDH1A1KDM4EPOLB

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-20170227690-A1 NEAR INFRARED RAY ABSORBENT COMPOSITION, NEAR INFRARED RAY CUT FILTER, SOLID IMAGE PICKUP ELEMENT, AND CAMERA MODULE FUJIFILM CORPORATION (JP) 2017-08-10 US disclosed
US-20160304730-A1 NEAR INFRARED RADIATION-ABSORBING COMPOSITION, NEAR INFRARED RADIATION CUT-OFF FILTER AND PRODUCTION METHOD THEREFOR, AND CAMERA MODULE AND PRODUCTION METHOD THEREFOR FUJIFILM CORPORATION (JP) 2016-10-20 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-20170227690-A1 NEAR INFRARED RAY ABSORBENT COMPOSITION, NEAR INFRARED RAY CUT FILTER, SOLID IMAGE PICKUP ELEMENT, AND CAMERA MODULE C9, SET, CRY1 MEN1 22/4885KMT2A 2562/4885ALDH1A1 2313/4885

“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.