SCHEMBL19214729

SCHEMBL19214729

CCC(Cc1ccccn1)Nc1cc(C(C)(C)C)ccc1OC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.43
MEN1 O00255 3/20 0.43
ALDH1A1 P00352 5/20 0.40
HPGD P15428 3/20 0.40
KDM4E B2RXH2 2/20 0.40
MAPT P10636 2/20 0.40
RECQL P46063 1/20 0.40
PKM P14618 2/20 0.40
HTT P42858 1/20 0.39
MAPK14 Q16539 1/20 0.39
ALOX15 P16050 2/20 0.38
PGK1 P00558 1/20 0.38
RAB9A P51151 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
GAA P10253 1/20 0.38
HSD17B10 Q99714 1/20 0.38
NPC1 O15118 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
SCHEMBL18158063 0.83 MEN1 (0.42) KMT2AMEN1ALDH1A1HPGDKDM4E
SCHEMBL20661548 0.81 CYP1A2 (0.37) KMT2AMEN1ALDH1A1HPGDKDM4E
SCHEMBL20024585 0.79 ALDH1A1 (0.55) KMT2AMEN1ALDH1A1HPGDKDM4E
SCHEMBL20661547 0.78 CYP3A4 (0.44) KMT2AMEN1ALDH1A1RAB9ACYP1A2
SCHEMBL19214720 0.71 IDO1 (0.43) ALDH1A1MAPTALOX15CYP1A2CYP2C19
SCHEMBL15701533 0.69 MRGPRX4 (0.52) ALDH1A1KDM4EMAPTRECQLRAB9A
SCHEMBL12261881 0.67 SYK (0.53) ALDH1A1KDM4ERAB9ACYP2C19GAA
SCHEMBL19214769 0.67 FERMT2 (0.42) ALDH1A1RECQLALOX15CYP1A2CYP2C19
SCHEMBL29067184 0.67 ALDH1A1 (0.49) KMT2AMEN1ALDH1A1KDM4EHTT
SCHEMBL13165240 0.65 SYK (0.64) KMT2AMEN1ALDH1A1RAB9ANPC1

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-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

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 KMT2A 2562/4885MEN1 22/4885ALDH1A1 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.