SCHEMBL19087503

SCHEMBL19087503

Cc1cccc(C)c1Nc1ccc([Si](C)(C)C)cc1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.56
RAPGEF4 Q8WZA2 7/20 0.44
CXCR2 P25025 1/20 0.40
HTR1D P28221 1/20 0.40
HDAC6 Q9UBN7 4/20 0.39
POLB P06746 1/20 0.39
LMNA P02545 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
TSHR P16473 1/20 0.38
RAB9A P51151 1/20 0.38
KDM1A O60341 2/20 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
SCHEMBL4278475 0.85 ALDH1A1 (0.72) ALDH1A1RAPGEF4CXCR2HTR1DHDAC6
SCHEMBL20598931 0.82 ALDH1A1 (0.50) ALDH1A1RAPGEF4CXCR2HTR1DHDAC6
SCHEMBL24106991 0.81 ALDH1A1 (0.53) ALDH1A1RAPGEF4CXCR2HTR1DPOLB
SCHEMBL5134264 0.79 RAPGEF4 (0.68) ALDH1A1RAPGEF4CXCR2RAB9AKDM1A
SCHEMBL1921964 0.79 ALDH1A1 (0.64) ALDH1A1RAPGEF4CXCR2HTR1DHDAC6
SCHEMBL915686 0.78 TDP1 (0.45) ALDH1A1LMNARAB9A
SCHEMBL2270398 0.78 ALDH1A1 (0.43) ALDH1A1POLBLMNACYP3A4TSHR
SCHEMBL24318169 0.77 ALDH1A1 (0.62) ALDH1A1RAPGEF4CXCR2POLBLMNA
SCHEMBL8014673 0.76 ALDH1A1 (0.61) ALDH1A1RAPGEF4CXCR2CYP3A4TSHR
SCHEMBL10569761 0.75 ALDH1A1 (0.55) ALDH1A1RAPGEF4CXCR2HTR1DLMNA

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-3654395-A1 ORGANIC LIGHT EMITTING DIODE HAVING HIGH EFFICIENCY SFC Co., Ltd. (KR) 2020-05-20 EP disclosed
US-20190006592-A1 NOVEL ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME MATERIAL SCIENCE CO., LTD. (KR) 2019-01-03 US disclosed
US-20180019430-A1 Organic light-emitting diode with high efficiency SFC CO., LTD. (KR) 2018-01-18 US disclosed
WO-2017116169-A1 NOVEL ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME 머티어리얼사이언스 주식회사 2017-07-06 WO 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 (2 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-20190006592-A1 NOVEL ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME OCIAD1, OCIAD2, ORC3 ALDH1A1 731/4885RAPGEF4 2260/4885CXCR2 1206/4885
US-20180019430-A1 Organic light-emitting diode with high efficiency CYBA, CYP1A1, CYP1B1 ALDH1A1 12/4885RAPGEF4 4109/4885CXCR2 2261/4885

“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.