SCHEMBL19600866

SCHEMBL19600866

CCn1c(=O)[nH]c2cc(C#N)c(C#N)cc21

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.59
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
LMNA P02545 2/20 0.59
CYP3A4 P08684 1/20 0.59
CYP2D6 P10635 1/20 0.59
TSHR P16473 1/20 0.59
NFKB1 P19838 1/20 0.59
BLM P54132 1/20 0.59
PMP22 Q01453 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
PGR P06401 4/20 0.45
GRIA1 P42261 1/20 0.42
GRIA2 P42262 1/20 0.42
GRIA3 P42263 1/20 0.42
GRIA4 P48058 1/20 0.42
MAOB P27338 3/20 0.41
L3MBTL1 Q9Y468 2/20 0.39
KDM4E B2RXH2 3/20 0.38
HPGD P15428 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
SCHEMBL16883632 0.78 CYP1A2 (0.55) CYP1A2MEN1KMT2ALMNACYP3A4
SCHEMBL6904350 0.76 CYP1A2 (0.67) CYP1A2MEN1KMT2ALMNACYP3A4
SCHEMBL12163026 0.75 ALDH1A1 (0.49) CYP1A2LMNASMN1; SMN2L3MBTL1KDM4E
SCHEMBL12163032 0.75 KDM4E (0.50) CYP1A2MEN1KMT2ALMNAGRIA1
SCHEMBL612079 0.75 CYP1A2 (1.00) CYP1A2MEN1KMT2ALMNACYP3A4
SCHEMBL6909295 0.75 CYP1A2 (0.65) CYP1A2MEN1KMT2ALMNACYP3A4
SCHEMBL6799574 0.75 CYP1A2 (0.65) CYP1A2MEN1KMT2ALMNACYP3A4
SCHEMBL7063351 0.75 CYP1A2 (0.65) CYP1A2MEN1KMT2ALMNACYP3A4
SCHEMBL29701185 0.75 CYP1A2 (1.00) CYP1A2MEN1KMT2ALMNACYP3A4
SCHEMBL20656269 0.72 CYP1A2 (0.51) CYP1A2MEN1KMT2ALMNACYP3A4

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9994580-B2 Phthalocyanine compound and method of preparing the same, color filter containing phthalocyanine compound, and coloring composition DIC CORPORATION (JP) 2018-06-12 US disclosed
US-9994580-B2 Phthalocyanine compound and method of preparing the same, color filter containing phthalocyanine compound, and coloring composition DIC CORPORATION (JP) 2018-06-12 US disclosed
US-20170327510-A1 PHTHALOCYANINE COMPOUND AND METHOD OF PREPARING THE SAME, COLOR FILTER CONTAINING PHTHALOCYANINE COMPOUND, AND COLORING COMPOSITION DIC CORPORATION (JP) 2017-11-16 US disclosed
US-20170327510-A1 PHTHALOCYANINE COMPOUND AND METHOD OF PREPARING THE SAME, COLOR FILTER CONTAINING PHTHALOCYANINE COMPOUND, AND COLORING COMPOSITION DIC CORPORATION (JP) 2017-11-16 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-20170327510-A1 PHTHALOCYANINE COMPOUND AND METHOD OF PREPARING THE SAME, COLOR FILTER CONTAINING PHTHALOCYANINE COMPOUND, AND COLORING COMPOSITION KMT5C, KMT5B, MAP1LC3C CYP1A2 3911/4885MEN1 2159/4885KMT2A 61/4885

“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.