SCHEMBL22243642

SCHEMBL22243642

CC1(C)c2ccc(Cl)cc2-c2ccc3oc4ccccc4c3c21

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 5/20 0.45
IDO1 P14902 2/20 0.40
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
KDM4E B2RXH2 1/20 0.36
NPC1 O15118 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
GABRP O00591 1/20 0.35
GABRD O14764 1/20 0.35
GABRA1 P14867 1/20 0.35
GABRB1 P18505 1/20 0.35
GABRG2 P18507 1/20 0.35
GABRB3 P28472 1/20 0.35
GABRA5 P31644 1/20 0.35
GABRA3 P34903 1/20 0.35
GABRA2 P47869 1/20 0.35

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
SCHEMBL20654637 0.91 AHR (0.46) AHRIDO1KMT2AMEN1KDM4E
SCHEMBL20654781 0.84 AHR (0.49) AHRIDO1KMT2AMEN1KDM4E
SCHEMBL17930628 0.83 MAOA (0.36) IDO1KMT2AMEN1KDM4ENPC1
SCHEMBL10042964 0.82 PDK2 (0.38) AHRKMT2AMEN1MAPTSMN1; SMN2
SCHEMBL18732007 0.81 AHR (0.42) AHRIDO1KMT2AMEN1KDM4E
SCHEMBL20023499 0.80 ALK (0.33) KMT2AMEN1KDM4ENPC1ALDH1A1
SCHEMBL23593240 0.80 AHR (0.45) AHRIDO1KMT2AMEN1NPC1
SCHEMBL20654782 0.80 AHR (0.57) AHRIDO1KMT2AMEN1KDM4E
SCHEMBL17945745 0.79 PLA2G2A (0.36) KMT2AMEN1KDM4ENPC1ALDH1A1
SCHEMBL22243941 0.79 TERT (0.35) KMT2AMEN1KDM4ENPC1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021015555-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE COMPRISING SAME ORGANIC ELECTRIC ELEMENT 덕산네오룩스 주식회사 2021-01-28 WO disclosed
US-20200231580-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT INCLUDING SAME DOOSAN CORPORATION (KR) 2020-07-23 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-20200231580-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT INCLUDING SAME SLCO4C1, SLCO2A1, POU2F1 AHR 1789/4885IDO1 3176/4885KMT2A 2200/4885

“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.