SCHEMBL1242129

SCHEMBL1242129

CCC(Cc1ccccc1)(Cc1ccc(N2CCOCC2)cc1)N(C)C.c1ncncn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RORC P51449 5/20 0.41
LMNA P02545 2/20 0.41
ADRA2A P08913 2/20 0.39
ADRA2B P18089 2/20 0.39
TMEM97 Q5BJF2 2/20 0.39
SIGMAR1 Q99720 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ADRA2C P18825 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
HPGD P15428 1/20 0.38
MAPT P10636 1/20 0.38
ALDH1A1 P00352 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
PDE10A Q9Y233 1/20 0.38
TSHR P16473 2/20 0.37
DRD4 P21917 1/20 0.37
HRH1 P35367 1/20 0.37
HTR2B P41595 1/20 0.37
PKM P14618 1/20 0.37
KDM4E B2RXH2 1/20 0.36

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
SCHEMBL1577100 0.94 LMNA (0.46) RORCLMNAADRA2AADRA2BTMEM97
SCHEMBL29378498 0.88 RORC (0.41) RORCLMNAADRA2AADRA2BTMEM97
Urea SCHEMBL27646729 0.87 SMN1; SMN2 (0.46) RORCLMNASMN1; SMN2L3MBTL1MAPT
Formamide SCHEMBL27646730 0.87 SMN1; SMN2 (0.44) RORCLMNAADRA2AADRA2BTMEM97
SCHEMBL28288263 0.86 RAB9A (0.43) LMNASMN1; SMN2L3MBTL1MAPTALDH1A1
SCHEMBL27663353 0.86 SLC13A5 (0.46) RORCLMNAADRA2AADRA2BTMEM97
Acetophenone SCHEMBL27571561 0.84 MAPT (0.45) RORCLMNASMN1; SMN2L3MBTL1MAPT
SCHEMBL466267 0.84 RAB9A (0.52) SMN1; SMN2L3MBTL1MAPTALDH1A1PKM
SCHEMBL18166511 0.83 MAPT (0.39) RORCLMNASMN1; SMN2L3MBTL1HPGD
SCHEMBL27871187 0.83 AOC3 (0.41) LMNASMN1; SMN2L3MBTL1MAPTALDH1A1

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
EP-1772494-B1 BORON SUBPHTHALOCYANINE PIGMENT DAINICHISEIKA COLOR CHEM (JP) 2012-12-05 EP disclosed
US-7888398-B2 chlorinated subphthalocyanine coordinated with boron trichloride; ink for color filter; blue-colored pixels of excellent lightfastness, solvent resistance and heat resistance; brightnesss; saturation; kneading with alcohol solvent and inorganic salt (NaCl): narrow particle size distribution DAINICHISEIKA COLOR & CHEMICALS MFG. CO., LTD. (JP) 2011-02-15 US disclosed
US-20080096999-A1 Pigment DAINICHISEIKA COLOR & CHEMICALS MFG. CO., LTD. (JP) 2008-04-24 US disclosed
EP-1772494-A1 PIGMENT DAINICHISEIKA COLOR & CHEMICALS MFG. CO. LTD. (JP) 2007-04-11 EP 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-20080096999-A1 Pigment IK, TYR, CRY1 RORC 1507/4885LMNA 3395/4885ADRA2A 1305/4885

“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.