SCHEMBL9612781

SCHEMBL9612781

CC(=O)c1cc2ccc(C(=O)O)cc2s1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLK1 P49759 1/20 0.51
DYRK1A Q13627 1/20 0.51
DYRK1B Q9Y463 1/20 0.51
HDAC1 Q13547 7/20 0.51
CA2 P00918 1/20 0.49
BCL2L1 Q07817 1/20 0.47
RAB9A P51151 4/20 0.46
NPC1 O15118 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
HDAC3 O15379 1/20 0.45
HDAC4 P56524 1/20 0.45
HDAC7 Q8WUI4 1/20 0.45
HDAC2 Q92769 1/20 0.45
HDAC10 Q969S8 1/20 0.45
HDAC11 Q96DB2 1/20 0.45
HDAC8 Q9BY41 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45
HDAC9 Q9UKV0 1/20 0.45
HDAC5 Q9UQL6 1/20 0.45
GPR35 Q9HC97 1/20 0.43

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
SCHEMBL8250577 0.87 BCL2L1 (0.61) HDAC1CA2BCL2L1RAB9ANPC1
SCHEMBL9612673 0.86 DYRK1A (0.65) CLK1DYRK1ADYRK1BHDAC1BCL2L1
SCHEMBL8260519 0.86 CA2 (0.56) CLK1DYRK1ADYRK1BHDAC1CA2
SCHEMBL9612674 0.82 HDAC1 (0.76) CLK1DYRK1ADYRK1BHDAC1CA2
SCHEMBL1886146 0.82 HDAC1 (0.67) HDAC1CA2BCL2L1RAB9ANPC1
SCHEMBL13709557 0.80 C1S (0.50) HDAC1CA2BCL2L1RAB9ANPC1
SCHEMBL3966584 0.79 RAB9A (0.53) HDAC1CA2RAB9ANPC1SMN1; SMN2
SCHEMBL15961987 0.79 DYRK1A (0.74) CLK1DYRK1ADYRK1BHDAC1CA2
SCHEMBL191958 0.79 HDAC1 (0.51) HDAC1CA2RAB9ANPC1SMN1; SMN2
SCHEMBL8905597 0.77 DYRK1A (0.53) CLK1DYRK1ADYRK1BHDAC1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103044390-B Manufacturing method of active layer of ultraviolet detector LIYANG PRODUCTIVITY PROMOTION CT 2015-02-25 CN claimed
CN-101906093-B Benzo five-membered unsaturated heterocycle compound and preparation method thereof INST MEDICINAL BIOTECHNOLOGY 2013-07-10 CN claimed
CN-103044390-A Manufacturing method of active layer of ultraviolet detector LIYANG PRODUCTIVITY PROMOTION CT 2013-04-17 CN claimed
CN-103044389-A Compound used as active layer of ultraviolet detector LIYANG PRODUCTIVITY PROMOTION CT 2013-04-17 CN claimed
CN-103050629-A Method for producing ultraviolet detector LIYANG PRODUCTIVITY PROMOTION CT 2013-04-17 CN claimed
CN-103050628-A Method for producing ultraviolet detector LIYANG PRODUCTIVITY PROMOTION CT 2013-04-17 CN claimed
CN-102997991-A Ultraviolet detection device LIYANG PRODUCTIVITY PROMOTION CT 2013-03-27 CN claimed
CN-102969450-A Ultraviolet detector LIYANG CITY PRODUCTIVITY PROMOTION CT 2013-03-13 CN claimed
CN-101906093-A Benzo five-membered unsaturated heterocycle compound and preparation method thereof INST OF MEDICINAL BIOTECHNOLOGY OF CHINESE ACADEMY OF MEDICAL SCIENCES 2010-12-08 CN claimed
CN-102969450-B A kind of ultraviolet detector 溧阳市生产力促进中心 2016-06-08 CN disclosed
CN-103050629-B A kind of manufacture method of ultraviolet detector LIYANG PRODUCTIVITY PROMOTION CENTER (CN) 2016-04-06 CN disclosed
CN-102997991-B A kind of ultraviolet detector LIYANG CITY PRODUCTIVITY PROMOTION CENTER (CN) 2016-01-06 CN disclosed
CN-103044390-B Manufacturing method of active layer of ultraviolet detector LIYANG PRODUCTIVITY PROMOTION CT 2015-02-25 CN disclosed
CN-101906093-B Benzo five-membered unsaturated heterocycle compound and preparation method thereof INST MEDICINAL BIOTECHNOLOGY 2013-07-10 CN disclosed
CN-102997991-A Ultraviolet detection device LIYANG PRODUCTIVITY PROMOTION CT 2013-03-27 CN disclosed
CN-102969450-A Ultraviolet detector LIYANG CITY PRODUCTIVITY PROMOTION CT 2013-03-13 CN disclosed
WO-2012068702-A1 BENZO 5-MEMBERED UNSATURATED HETEROCYCLIC COMPOUNDS AND PREPARATION METHODS THEREOF 中国医学科学院医药生物技术研究所 (CN) 2012-05-31 WO disclosed
CN-101906093-A Benzo five-membered unsaturated heterocycle compound and preparation method thereof INST OF MEDICINAL BIOTECHNOLOGY OF CHINESE ACADEMY OF MEDICAL SCIENCES 2010-12-08 CN disclosed
US-7834034-B2 Benzothiophene derivatives MERCK SHARP & DOHME CORP. (US) 2010-11-16 US disclosed
US-20090082308-A1 Benzothiophene derivatives MERCK SHARP & DOHME LLC 2009-03-26 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-20090082308-A1 Benzothiophene derivatives BRDT, HDAC5, BRPF3 CLK1 4160/4885DYRK1A 2841/4885DYRK1B 3059/4885

“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.