SCHEMBL3888554

SCHEMBL3888554

CC(C)(C)c1ccc2c(c1)Cc1cc(C(C)(C)C)cc(Br)c1-2

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
PLA2G1B P04054 1/20 0.35
NFKB1 P19838 1/20 0.35
CASP3 P42574 1/20 0.35
NFKB2 Q00653 1/20 0.35
RELA Q04206 1/20 0.35
SENP8 Q96LD8 1/20 0.35
SENP7 Q9BQF6 1/20 0.35
SENP6 Q9GZR1 1/20 0.35
ATG4B Q9Y4P1 1/20 0.35
CYP1A2 P05177 2/20 0.34
CYP2C19 P33261 2/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
HIF1A Q16665 1/20 0.34
ALOX15 P16050 3/20 0.34
HSD17B10 Q99714 2/20 0.34

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
SCHEMBL30430052 1.00 ALDH1A1 (0.35) ALDH1A1NPC1RAB9AL3MBTL1PLA2G1B
SCHEMBL2615694 0.88 ALDH1A1 (0.36) ALDH1A1NPC1RAB9AL3MBTL1PLA2G1B
SCHEMBL5820431 0.83 ALDH1A1 (0.35) ALDH1A1NPC1RAB9AL3MBTL1PLA2G1B
SCHEMBL13959164 0.83 NPC1 (0.39) NPC1RAB9ACYP1A2CYP2C19CYP2D6
SCHEMBL5437344 0.83 ALDH1A1 (0.37) ALDH1A1NPC1RAB9AL3MBTL1PLA2G1B
SCHEMBL25633605 0.80 ELANE (0.36) ALDH1A1NPC1RAB9AL3MBTL1PLA2G1B
SCHEMBL40372 0.80 ALDH1A1 (0.45) ALDH1A1NPC1RAB9AL3MBTL1PLA2G1B
SCHEMBL29459210 0.80 ALDH1A1 (0.45) ALDH1A1NPC1RAB9AL3MBTL1PLA2G1B
SCHEMBL5820049 0.79 KIF11 (0.38) ALDH1A1NPC1RAB9AL3MBTL1PLA2G1B
Lithium SCHEMBL6552341 0.78 ALDH1A1 (0.44) ALDH1A1NPC1RAB9AL3MBTL1PLA2G1B

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 50 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109665938-A A kind of -9 ' of bromo- 9- methyl of 4--phenyl fluorenes production method 河南省科学院化学研究所有限公司 2019-04-23 CN claimed
CN-104151130-B A kind of method preparing high purity 4-bromine fluorenes VALIANT Co.,Ltd. (CN) 2016-04-06 CN claimed
CN-104151130-A Novel method for preparing high-purity 4-bromofluorene YANTAI VALIANT FINE CHEMICALS CO LTD 2014-11-19 CN claimed
US-7473813-B2 Process for the preparation of substituted fluorenes FINA TECHNOLOGY, INC. (US) 2009-01-06 US claimed
US-20070015946-A1 Process for the preparation of substituted fluorenes MARIN VLADIMIR 2007-01-18 US claimed
EP-2838929-B1 POLYMERS CONTAINING SUBSTITUTED TRIARYLAMINE UNITS AND ELECTROLUMINESCENT DEVICES CONTAINING SAID POLYMERS MERCK PATENT GMBH (DE) 2023-06-14 EP disclosed
EP-2838929-B1 POLYMERS CONTAINING SUBSTITUTED TRIARYLAMINE UNITS AND ELECTROLUMINESCENT DEVICES CONTAINING SAID POLYMERS MERCK PATENT GMBH (DE) 2023-06-14 EP disclosed
EP-2838930-B1 POLYMERS CONTAINING SUBSTITUTED OLIGO-TRIARYLAMINE UNITS AND ELECTROLUMINESCENCE DEVICES CONTAINING SUCH POLYMERS MERCK PATENT GMBH (DE) 2020-10-14 EP disclosed
EP-2838930-B1 POLYMERS CONTAINING SUBSTITUTED OLIGO-TRIARYLAMINE UNITS AND ELECTROLUMINESCENCE DEVICES CONTAINING SUCH POLYMERS MERCK PATENT GMBH (DE) 2020-10-14 EP disclosed
CN-109665938-A A kind of -9 ' of bromo- 9- methyl of 4--phenyl fluorenes production method 河南省科学院化学研究所有限公司 2019-04-23 CN disclosed
CN-109665938-A A kind of -9 ' of bromo- 9- methyl of 4--phenyl fluorenes production method 河南省科学院化学研究所有限公司 2019-04-23 CN disclosed
CN-104271632-B Polymer containing substituted triaryl amine unit and include the electroluminescent device of these polymer 默克专利有限公司 2018-08-31 CN disclosed
WO-2008016904-A2 ISOTACTIC-ATACTIC POLYPROPYLENE AND METHODS OF MAKING SAME FINA TECHNOLOGY, INC. (US) 2008-02-07 WO disclosed
US-20080027193-A1 ISOTACTIC-ATACTIC POLYPROPYLENE AND METHODS OF MAKING SAME FINA TECHNOLOGY, INC. (US) 2008-01-31 US disclosed
US-20070015946-A1 Process for the preparation of substituted fluorenes MARIN VLADIMIR 2007-01-18 US disclosed
US-20070015946-A1 Process for the preparation of substituted fluorenes MARIN VLADIMIR 2007-01-18 US disclosed
US-20070015946-A1 Process for the preparation of substituted fluorenes MARIN VLADIMIR 2007-01-18 US disclosed
WO-2006137818-A1 CATALYST COMPONENTS AND THEIR USE IN THE POLYMERIZATION OF OLEFINS FINA TECHNOLOGY, INC. (US) 2006-12-28 WO disclosed
US-7094938-B1 Process for the preparation of substituted fluorenes FINA TECHNOLOGY, INC. (US) 2006-08-22 US disclosed
US-20050148460-A1 Catalyst components and their use in the polymerization of olefins FINA TECHNOLOGY, INC. 2005-07-07 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 (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-20070015946-A1 Process for the preparation of substituted fluorenes TFDP2, ZKSCAN2, MDM4 ALDH1A1 3383/4885NPC1 3989/4885RAB9A 4400/4885
US-20050148460-A1 Catalyst components and their use in the polymerization of olefins NPY5R, SSTR5, FGR ALDH1A1 4091/4885NPC1 3753/4885RAB9A 3013/4885

“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.