SCHEMBL3757832

SCHEMBL3757832

COc1cccc(O)c1OCc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BCHE P06276 13/20 0.58
L3MBTL1 Q9Y468 2/20 0.56
KDM4E B2RXH2 1/20 0.56
HTR1A P08908 2/20 0.55
ADRA1D P25100 2/20 0.55
ADRA1A P35348 2/20 0.55
ADRA1B P35368 2/20 0.55
MAPT P10636 1/20 0.51
MAPK1 P28482 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
LMNA P02545 1/20 0.51
HPGD P15428 1/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51

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
Formic Acid SCHEMBL28842421 0.93 BCHE (0.56) BCHEL3MBTL1KDM4EHTR1AADRA1D
SCHEMBL1952684 0.88 HTR1A (0.63) L3MBTL1KDM4EHTR1AADRA1DADRA1A
SCHEMBL29859200 0.88 BCHE (0.53) BCHEL3MBTL1KDM4EHTR1AADRA1D
SCHEMBL21300617 0.88 BCHE (0.67) BCHEL3MBTL1KDM4EHTR1AADRA1D
SCHEMBL30445162 0.87 HTR1A (0.58) BCHEL3MBTL1HTR1AADRA1DADRA1A
SCHEMBL11019947 0.87 HTR1A (0.58) BCHEL3MBTL1HTR1AADRA1DADRA1A
SCHEMBL18623128 0.84 HTR1A (0.68) BCHEL3MBTL1KDM4EHTR1AADRA1D
SCHEMBL27488692 0.84 HTR1A (0.61) L3MBTL1HTR1AADRA1DADRA1AADRA1B
SCHEMBL29000550 0.81 HTR1A (0.57) BCHEL3MBTL1HTR1AADRA1DADRA1A
SCHEMBL12843212 0.81 BCHE (0.60) BCHEL3MBTL1KDM4EHTR1AADRA1D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104860908-B Method for synthesizing BNC105 广东颐正达医药科技有限公司 2017-03-22 CN claimed
CN-104860908-A Method for synthesizing BNC105 GUANGDONG YIZHENGDA PHARMACEUTICAL TECHNOLOGY CO LTD 2015-08-26 CN claimed
CN-116848110-A Deuterated colony stimulating factor-1 receptor (CSF-1R) inhibitors 建新公司 2023-10-03 CN disclosed
CN-107922396-B Colony stimulating factor-1 receptor (CSF-1R) inhibitors 建新公司 2022-08-05 CN disclosed
CN-104860908-B Method for synthesizing BNC105 广东颐正达医药科技有限公司 2017-03-22 CN disclosed
CN-104860908-A Method for synthesizing BNC105 GUANGDONG YIZHENGDA PHARMACEUTICAL TECHNOLOGY CO LTD 2015-08-26 CN disclosed
US-8557982-B2 Tubulin polymerisation inhibitors BIONOMICS LIMITED (AU) 2013-10-15 US disclosed
US-20120309768-A1 NOVEL TUBULIN POLYMERISATION INHIBITORS BIONOMICS LIMITED (AU) 2012-12-06 US disclosed
US-8278290-B2 Tubulin polymerisation inhibitors Biononics Limited (AU) 2012-10-02 US disclosed
US-20100292190-A1 NOVEL TUBULIN POLYMERISATION INHIBITORS BIONOMICS LIMITED (AU) 2010-11-18 US disclosed
EP-1848704-A1 NOVEL TUBULIN POLYMERISATION INHIBITORS Bionomics Limited (AU) 2007-10-31 EP disclosed
EP-0928791-A1 PROCESS FOR PRODUCING 1,4-BENZODIOXANE DERIVATIVES DAISO CO., LTD. (JP) 1999-07-14 EP disclosed
US-5780650-A Process for preparation of 1,4-benzodioxane derivative DAISO CO., LTD. (JP) 1998-07-14 US disclosed
US-5753641-A SYNERGISTIC THERAPY COMPRISING FINASTERIDE AND TERAZOSIN DRUGS MERCK & CO., INC. (US) 1998-05-19 US disclosed
EP-0841334-A1 PROCESS FOR PRODUCING 1,4-BENZODIOXANE DERIVATIVES DAISO CO., LTD. (JP) 1998-05-13 EP disclosed
EP-0576603-A1 PHARMACEUTICAL COMBINATION FOR THE TREATMENT OF PROSTATIC HYPERPLASIA, CONTAINING A 5 ALPHA-REDUCTASE INHIBITOR AND AN ANTIANDROGEN MERCK & CO. INC. (US) 1994-01-05 EP disclosed
EP-0525888-A1 New catechol type non-steroidal drugs as 5-alpha reductase inhibitors MERCK & CO. INC. (US) 1993-02-03 EP disclosed
WO-1992018132-A1 PHARMACEUTICAL COMBINATION FOR THE TREATMENT OF BENIGN PROSTATIC HYPERPLASIA COMTAINING A 5 ALPHA-REDUCTASE INHIBITOR MERCK & CO., INC. (US) 1992-10-29 WO disclosed
WO-1992016213-A1 PHARMACEUTICAL COMBINATION FOR THE TREATMENT OF PROSTATIC HYPERPLASIA, CONTAINING A 5 ALPHA-REDUCTASE INHIBITOR AND AN ANTIANDROGEN MERCK & CO., INC. (US) 1992-10-01 WO disclosed
WO-1992016233-A1 PHARMACEUTICAL COMBINATION FOR THE TREATMENT OF PROSTATIC CANCER CONTAINING A 5 ALPHA REDUCTASE INHIBITOR AND AN ANTIANDROGEN MERCK & CO., INC. (US) 1992-10-01 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-20100292190-A1 NOVEL TUBULIN POLYMERISATION INHIBITORS TUBB1, TUBA1C, TUBB BCHE 3606/4885L3MBTL1 3961/4885KDM4E 3805/4885
US-20120309768-A1 NOVEL TUBULIN POLYMERISATION INHIBITORS TUBB1, TUBA1C, TUBB BCHE 3606/4885L3MBTL1 3961/4885KDM4E 3805/4885

“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.