SCHEMBL984121

SCHEMBL984121

CC(C)(C)c1ccc(Cc2ccc(C(C)(C)C)cc2Br)c(Br)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.46
CYP2C19 P33261 2/20 0.46
ALDH1A1 P00352 6/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
MAPT P10636 2/20 0.41
RECQL P46063 2/20 0.41
GAA P10253 1/20 0.41
PKM P14618 1/20 0.41
HIF1A Q16665 3/20 0.41
CYP2D6 P10635 2/20 0.41
CYP2C9 P11712 1/20 0.41
ALOX15 P16050 5/20 0.40
HSD17B10 Q99714 4/20 0.40
HPGD P15428 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
HTR1D P28221 4/20 0.39
HTR1B P28222 2/20 0.39
ADRA2A P08913 1/20 0.39
ADRA2B P18089 1/20 0.39

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
SCHEMBL11546049 0.85 CYP1A2 (0.44) CYP1A2CYP2C19ALDH1A1MEN1KMT2A
SCHEMBL1320175 0.85 CYP1A2 (0.44) CYP1A2CYP2C19ALDH1A1MEN1KMT2A
SCHEMBL30558280 0.85 CYP1A2 (0.44) CYP1A2CYP2C19ALDH1A1MEN1KMT2A
SCHEMBL19037781 0.83 KLF10 (0.44) CYP1A2CYP2C19ALDH1A1MEN1KMT2A
SCHEMBL840783 0.83 ALDH1A1 (0.55) CYP1A2CYP2C19ALDH1A1MEN1KMT2A
SCHEMBL31268407 0.80 CYP1A2 (0.41) CYP1A2CYP2C19ALDH1A1MEN1KMT2A
SCHEMBL13073947 0.80 CYP1A2 (0.41) CYP1A2CYP2C19ALDH1A1MEN1KMT2A
SCHEMBL29284733 0.79 CYP1A2 (0.40) CYP1A2CYP2C19ALDH1A1MEN1KMT2A
SCHEMBL4791194 0.79 CYP1A2 (0.40) CYP1A2CYP2C19ALDH1A1MEN1KMT2A
SCHEMBL1134714 0.77 ALDH1A1 (0.46) CYP1A2CYP2C19ALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12398089-B2 Method for preparing organic carboxylic ester by using combined catalyst of aryl bidentate phosphine ligand NANJING CHENGZHI CLEAN ENERGY CO. LTD. (CN) 2025-08-26 US disclosed
US-20230309389-A1 CONDENSED CYCLIC COMPOUND, ORGANIC LIGHT EMITTING DEVICE INCLUDING CONDENSED CYCLIC COMPOUND, AND ELECTRONIC APPARATUS INCLUDING ORGANIC LIGHT EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2023-09-28 US disclosed
US-20220298097-A1 METHOD FOR PREPARING ORGANIC CARBOXYLIC ESTER BY USING COMBINED CATALYST OF ARYL BIDENTATE PHOSPHINE LIGAND NANJING CHENGZHI CLEAN ENERGY CO. LTD. (CN) 2022-09-22 US disclosed
CN-111087306-B Method for preparing organic carboxylic ester by aryl bidentate phosphine ligand combined catalysis 南京诚志清洁能源有限公司 2021-08-03 CN disclosed
WO-2021129138-A1 METHOD FOR PREPARING ORGANIC CARBOXYLIC ESTER BY MEANS OF COMBINATORIAL CATALYSIS WITH ARYL BIDENTATE PHOSPHINE LIGAND 南京诚志清洁能源有限公司 2021-07-01 WO disclosed
WO-2021129138-A1 METHOD FOR PREPARING ORGANIC CARBOXYLIC ESTER BY MEANS OF COMBINATORIAL CATALYSIS WITH ARYL BIDENTATE PHOSPHINE LIGAND 南京诚志清洁能源有限公司 2021-07-01 WO disclosed
CN-111087306-A Method for preparing organic carboxylic ester by aryl bidentate phosphine ligand combined catalysis 南京诚志清洁能源有限公司 2020-05-01 CN disclosed
WO-2015144133-A1 ARYL BORANE COMPOUND, METHOD FOR THE PRODUCTION THEREOF AND USE THEREOF Johann Wolfgang Goethe-Universität (DE) 2015-10-01 WO disclosed
US-8288602-B2 Synthesis of substituted fluorene ligands TOTAL PETROCHEMICALS RESEARCH FELUY (BE) 2012-10-16 US disclosed
US-8288602-B2 Synthesis of substituted fluorene ligands TOTAL PETROCHEMICALS RESEARCH FELUY (BE) 2012-10-16 US disclosed
US-8288602-B2 Synthesis of substituted fluorene ligands TOTAL PETROCHEMICALS RESEARCH FELUY (BE) 2012-10-16 US disclosed
US-20110009683-A1 SYNTHESIS OF SUBSTITUTED FLUORENE LIGANDS TOTAL PETROCHEMICALS RESEARCH FELUY (BE) 2011-01-13 US disclosed
US-20110009683-A1 SYNTHESIS OF SUBSTITUTED FLUORENE LIGANDS TOTAL PETROCHEMICALS RESEARCH FELUY (BE) 2011-01-13 US disclosed
US-20110009683-A1 SYNTHESIS OF SUBSTITUTED FLUORENE LIGANDS TOTAL PETROCHEMICALS RESEARCH FELUY (BE) 2011-01-13 US disclosed
EP-1999091-B1 SYNTHESIS OF SUBSTITUTED FLUORENES TOTAL PETROCHEMICALS RES FELUY (BE) 2010-08-04 EP disclosed
EP-1999091-B1 SYNTHESIS OF SUBSTITUTED FLUORENES TOTAL PETROCHEMICALS RES FELUY (BE) 2010-08-04 EP disclosed
WO-2007111537-A2 SYNTHESIS OF SUBSTITUTED FLUORENES GOSUDARSTVENNOE UCHEBNO-NAUCHNOE UCHREZHDENIE KHIMICHESKY FAKULTET MOSKOVSKOGO GOSUDARSTVENNOGO UNIVERSITETA IM. M.V.LOMONOSOVA (RU) 2007-10-04 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 (4 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-20230309389-A1 CONDENSED CYCLIC COMPOUND, ORGANIC LIGHT EMITTING DEVICE INCLUDING CONDENSED CYCLIC COMPOUND, AND ELECTRONIC APPARATUS INCLUDING ORGANIC LIGHT EMITTING DEVICE CRY1, OCIAD1, ORC3 CYP1A2 693/4885CYP2C19 353/4885ALDH1A1 170/4885
US-20110009683-A1 SYNTHESIS OF SUBSTITUTED FLUORENE LIGANDS FDPS, FLNB, PFAS CYP1A2 262/4885CYP2C19 989/4885ALDH1A1 2283/4885
US-20220298097-A1 METHOD FOR PREPARING ORGANIC CARBOXYLIC ESTER BY USING COMBINED CATALYST OF ARYL BIDENTATE PHOSPHINE LIGAND POF1B, ADH1C, OSBP CYP1A2 254/4885CYP2C19 197/4885ALDH1A1 447/4885
US-12398089-B2 Method for preparing organic carboxylic ester by using combined catalyst of aryl bidentate phosphine ligand POF1B, ADH1C, OSBP CYP1A2 254/4885CYP2C19 197/4885ALDH1A1 447/4885

“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.