SCHEMBL13367461

SCHEMBL13367461

Cc1cccc(N(C)c2cc3ccccc3c3ccccc23)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.45
CSF1R P07333 5/20 0.40
EGFR P00533 5/20 0.40
CYP1A2 P05177 4/20 0.40
MAPT P10636 2/20 0.40
NR1I2 O75469 1/20 0.40
LMNA P02545 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
MAPK1 P28482 1/20 0.40
CYP2C19 P33261 1/20 0.40
HTR2B P41595 1/20 0.40
CYP51A1 Q16850 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TSHR P16473 1/20 0.38
CYP2A6 P11509 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38

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
SCHEMBL13367392 0.87 CYP1A2 (0.44) SIGMAR1CYP1A2MAPTLMNATDP1
SCHEMBL6283168 0.85 SIGMAR1 (0.43) SIGMAR1CYP1A2MAPTNR1I2LMNA
SCHEMBL12048720 0.84 TRPM4 (0.41) SIGMAR1EGFRMAPTLMNATSHR
SCHEMBL12258281 0.83 CYP1A2 (0.40) CYP1A2MAPTLMNATDP1TSHR
SCHEMBL12048739 0.83 SIGMAR1 (0.50) SIGMAR1CSF1REGFRCYP1A2MAPT
SCHEMBL13338636 0.83 SIGMAR1 (0.39) SIGMAR1CSF1REGFRCYP1A2MAPT
SCHEMBL18055161 0.83 SIGMAR1 (0.41) SIGMAR1CYP1A2MAPTNR1I2LMNA
SCHEMBL13367462 0.83 PDE5A (0.41) SIGMAR1EGFRCYP1A2PDGFRBKDR
SCHEMBL7800521 0.81 SIGMAR1 (0.40) SIGMAR1CYP1A2MAPTNR1I2LMNA
SCHEMBL12048256 0.80 CYP1A2 (0.35) EGFRCYP1A2MAPTLMNACYP3A4

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-20100108997-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-05-06 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-20100108997-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same OR10J3, OCIAD1, OCIAD2 SIGMAR1 699/4885CSF1R 2428/4885EGFR 1659/4885

“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.