Sugi Predict

Sugi Predict / Compounds / SCHEMBL12377924

SCHEMBL12377924

SCHEMBL12377924

Cc1c(Br)c2ccccc2c2cc(Br)ccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ ESR2 Q92731 1/20 0.38
▸ MAPK1 P28482 2/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ CYP2A6 P11509 1/20 0.35
▸ HPGD P15428 2/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ CASP1 P29466 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ CASP7 P55210 1/20 0.34
▸ ATM Q13315 1/20 0.34
▸ HIF1A Q16665 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ LMNA P02545 1/20 0.33
▸ PTGES O14684 1/20 0.33
▸ PRNP P04156 2/20 0.33

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
SCHEMBL28583244 0.90 KMT2A (0.44) RXFP1MEN1KMT2AESR2MAPK1
SCHEMBL19757717 0.85 ESR2 (0.41) RXFP1MEN1KMT2AESR2MAPK1
SCHEMBL9307379 0.85 CYP1A2 (0.41) MAPK1ALDH1A1CYP2A6HPGDCYP3A4
SCHEMBL22888829 0.84 KIF11 (0.41) MEN1KMT2AMAPK1ALDH1A1CYP2A6
SCHEMBL19713318 0.83 MAPK1 (0.43) RXFP1MEN1KMT2AESR2MAPK1
SCHEMBL21636087 0.82 MEN1 (0.52) RXFP1MEN1KMT2AMAPK1ALDH1A1
SCHEMBL21764548 0.82 MEN1 (0.52) RXFP1MEN1KMT2AMAPK1ALDH1A1
SCHEMBL312606 0.82 MEN1 (0.52) RXFP1MEN1KMT2AMAPK1ALDH1A1
Triphenylene SCHEMBL1923284 0.82 MEN1 (0.52) RXFP1MEN1KMT2AMAPK1ALDH1A1
SCHEMBL16076434 0.82 MEN1 (0.52) RXFP1MEN1KMT2AMAPK1ALDH1A1

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-10121974-B2 Condensed-cyclic compound and organic light-emitting device comprising the same SAMSUNG DISPLAY CO., LTD. (KR) 2018-11-06 — — US disclosed
US-20160190449-A1 CONDENSED-CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2016-06-30 — — US disclosed
US-20110186831-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE ELEMENT USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2011-08-04 — — US disclosed
US-20110186831-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE ELEMENT USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2011-08-04 — — 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 (3 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-10121974-B2 Condensed-cyclic compound and organic light-emitting device comprising the same CCNT1, CRY1, CCNA1 RXFP1 407/4885MEN1 248/4885KMT2A 2891/4885
US-20160190449-A1 CONDENSED-CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING THE SAME CCNT1, CRY1, CCNA1 RXFP1 462/4885MEN1 230/4885KMT2A 2809/4885
US-20110186831-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE ELEMENT USING SAME CTCF, SOX18, HNRNPH3 RXFP1 3063/4885MEN1 957/4885KMT2A 283/4885

“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.