SCHEMBL352142

SCHEMBL352142

[CH]1CCCCN1C1CCNCC1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 3/20 0.33
HTR2B P41595 2/20 0.33
HTR2A P28223 1/20 0.32
HTR6 P50406 1/20 0.31
L3MBTL3 Q96JM7 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
PKM P14618 1/20 0.31
ALOX15 P16050 1/20 0.31
KMT2A Q03164 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL5969664 0.98 HTR2C (0.32) HTR2CHTR2BHTR2AHTR6L3MBTL3
SCHEMBL2265420 0.94 HTR2C (0.33) HTR2CHTR2BHTR2AMEN1ALDH1A1
SCHEMBL8491316 0.88 HTR6 (0.41) HTR6
SCHEMBL738778 0.84
SCHEMBL735596 0.82 CTDSP1 (0.34) HTR6
SCHEMBL6641164 0.82 CTDSP1 (0.34) HTR6
SCHEMBL738719 0.82 CTDSP1 (0.34)
SCHEMBL2553676 0.82 HTR6 (0.38) HTR2CHTR2BHTR6
SCHEMBL737622 0.80 CTDSP1 (0.33) HTR6MEN1KMT2A
SCHEMBL2007704 0.80 CTDSP1 (0.33) HTR6MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3122744-B1 DIAZASPIROALKANEONE-SUBSTITUTED OXAZOLE DERIVATIVES AS SPLEEN TYROSINE KINASE INHIBITORS AB SCIENCE (FR) 2018-11-07 EP claimed
EP-2736904-B1 OXAZOLE AND THIAZOLE DERIVATIVES AS SELECTIVE PROTEIN KINASE INHIBITORS (C-KIT) AB SCIENCE (FR) 2016-03-16 EP claimed
EP-1960372-B1 KINASE INHIBITORS AND THEIR USES RIGEL PHARMACEUTICALS INC (US) 2015-12-09 EP claimed
US-9168245-B2 Selective protein kinase inhibitors AB SCIENCE (FR) 2015-10-27 US claimed
US-20140179698-A1 SELECTIVE PROTEIN KINASE INHIBITORS AB SCIENCE (FR) 2014-06-26 US claimed
EP-2736904-A1 OXAZOLE AND THIAZOLE DERIVATIVES AS SELECTIVE PROTEIN KINASE INHIBITORS (C-KIT) AB Science (FR) 2014-06-04 EP claimed
WO-2013014170-A1 OXAZOLE AND THIAZOLE DERIVATIVES AS SELECTIVE PROTEIN KINASE INHIBITORS (C-KIT) AB SCIENCE (FR) 2013-01-31 WO claimed
US-8053434-B2 Kinase inhibitors and their uses RIGEL PHARMACEUTICALS, INC. (US) 2011-11-08 US claimed
US-20100069369-A1 Kinase Inhibitors And Their Uses RIGEL PHARMACEUTICALS, INC. (US) 2010-03-18 US claimed
US-7601713-B2 Kinase inhibitors and their uses RIGEL PHARMACEUTICALS, INC. (US) 2009-10-13 US claimed
US-6593327-B2 N-cyanomethyl amides which are cysteine protease inhibitors; treating osteoporosis; mixtures with bisphosphonates AXYS PHARMACEUTICALS, INC. 2003-07-15 US claimed
EP-3253749-B1 COMPOUNDS WITH ANTI-TUMORAL ACTIVITY AB SCIENCE (FR) 2021-12-08 EP disclosed
EP-3350176-B1 NOVEL OXAZOLE DERIVATIVES THAT INHIBIT SYK AB SCIENCE (FR) 2021-04-28 EP disclosed
EP-3053920-B1 COMPOUNDS WITH ANTI-TUMORAL ACTIVITY AB SCIENCE (FR) 2020-04-08 EP disclosed
US-10570122-B2 Compounds with anti-tumoral activity AB SCIENCE (FR) 2020-02-25 US disclosed
US-6492362-B1 Compounds and compositions as cathepsin S inhibitors AXYS PHARMACEUTICALS, INC. 2002-12-10 US disclosed
US-6476026-B1 Compounds and compositions as protease inhibitors AXYS PHARMACEUTICALS, INC. 2002-11-05 US disclosed
US-20020156063-A1 Arylacetamido-ketobenzoxazole as cysteine protease inhibitors AXYS PHARMACEUTICALS, INC. 2002-10-24 US disclosed
US-6455502-B1 Compounds and compositions as protease inhibitors AXYS PHARMACEUTICALS, INC. 2002-09-24 US disclosed
US-20020086996-A1 Novel compounds and compositions as protease inhibitors AXYS PHARMACEUTICALS, INC. (US) 2002-07-04 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 (5 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-20020156063-A1 Arylacetamido-ketobenzoxazole as cysteine protease inhibitors SERPINB1, SPINT2, PRSS1 HTR2C 3831/4885HTR2B 3288/4885HTR2A 4206/4885
US-20020086996-A1 Novel compounds and compositions as protease inhibitors CTRL, SERPINB1, CPN1 HTR2C 4375/4885HTR2B 3966/4885HTR2A 4434/4885
US-10570122-B2 Compounds with anti-tumoral activity MKI67, GZMB, RB1 HTR2C 4546/4885HTR2B 3848/4885HTR2A 4541/4885
US-20100069369-A1 Kinase Inhibitors And Their Uses BTK, SYK, JAK2 HTR2C 3644/4885HTR2B 2379/4885HTR2A 3723/4885
US-20140179698-A1 SELECTIVE PROTEIN KINASE INHIBITORS KIT, MAP3K1, PRKCH HTR2C 2777/4885HTR2B 2346/4885HTR2A 2139/4885

“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.