SCHEMBL1978589

SCHEMBL1978589

COC(=O)c1c[c]ccc1O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.55
TSHR P16473 1/20 0.55
CA1 P00915 7/20 0.52
CA2 P00918 7/20 0.52
CA9 Q16790 6/20 0.52
CA12 O43570 5/20 0.52
CA7 P43166 5/20 0.52
CA14 Q9ULX7 5/20 0.52
PDK2 Q15119 1/20 0.47
PDK4 Q16654 1/20 0.47
GAA P10253 2/20 0.44
PTGS2 P35354 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
XDH P47989 2/20 0.40
ALDH1A1 P00352 1/20 0.40
CFTR P13569 1/20 0.40
HSD17B10 Q99714 1/20 0.40
CA5A P35218 1/20 0.40
MYC P01106 1/20 0.39
KDM4E B2RXH2 3/20 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
SCHEMBL3334103 0.85 LMNA (0.55) LMNATSHRCA1CA2CA9
SCHEMBL130031 0.84 TSHR (0.44) LMNATSHRCA1CA2CA9
SCHEMBL2551744 0.82 TSHR (0.42) LMNATSHRCA1CA2CA9
SCHEMBL971903 0.80 CA12 (0.56) TSHRCA1CA2CA9CA12
SCHEMBL5462595 0.80 SMN1; SMN2 (0.59) LMNATSHRCA1CA2CA9
SCHEMBL2443988 0.79 GAA (0.45) LMNATSHRCA1CA2GAA
SCHEMBL1196349 0.79 ALDH1A1 (0.56) LMNATSHRCA1CA2CA9
SCHEMBL1476818 0.79 KMT2A (0.41) LMNATSHRCA1CA2CA9
SCHEMBL5465624 0.79 ABL1 (0.42) LMNATSHRCA1CA2CA9
SCHEMBL7421653 0.79 TSHR (0.40) LMNATSHRCA1CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3242872-B1 (PIPERIDIN-3-YL)(NAPHTHALEN-2-YL)METHANONE DERIVATIVES AND RELATED COMPOUNDS AS INHIBITORS OF THE HISTONE DEMETHYLASE KDM2B FOR THE TREATMENT OF CANCER GENENTECH INC (US) 2019-07-03 EP claimed
US-10280149-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2019-05-07 US claimed
US-20180022727-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2018-01-25 US claimed
EP-3242872-A1 (PIPERIDIN-3-YL)(NAPHTHALEN-2-YL)METHANONE DERIVATIVES AND RELATED COMPOUNDS AS INHIBITORS OF THE HISTONE DEMETHYLASE KDM2B FOR THE TREATMENT OF CANCER Genentech, Inc. (US) 2017-11-15 EP claimed
WO-2016112284-A1 (PIPERIDIN-3-YL)(NAPHTHALEN-2-YL)METHANONE DERIVATIVES AND RELATED COMPOUNDS AS INHIBITORS OF THE HISTONE DEMETHYLASE KDM2B FOR THE TREATMENT OF CANCER GENENTECH, INC. (US) 2016-07-14 WO claimed
CN-104211699-A Beta-carboline derivatives, preparation, nano structure, antitumor activity and applications thereof UNIV CAPITAL MEDICAL SCIENCES 2014-12-17 CN claimed
US-7211695-B2 β2-adrenergic receptor agonists THERAVANCE, INC. (US) 2007-05-01 US claimed
US-20060183918-A1 Beta 2-adrenergic receptor agonists THERAVANCE BIOPHARMA R&D IP, LLC 2006-08-17 US claimed
US-3993852-A DIALKYL PHENYLALKANEPHOSPHONATES CIBA-GEIGY AG (CH) 1976-11-23 US claimed
CN-107406414-B (piperidin-3-yl) (naphthalen-2-yl) methanone derivatives as inhibitors of histone demethylase KDM2B for the treatment of cancer 基因泰克公司 2022-04-19 CN disclosed
EP-3878837-A1 2,5- OR 2,6-DISUBSTITUTED HYDROQUINONE DERIVATIVES WITH AT LEAST ONE CARBOXY, SULFO OR AMIDO GROUP USEFUL AS MEDICAMENTS OM Pharma SA (CH) 2021-09-15 EP disclosed
CN-107501392-B 1-substituted-beta-carboline-3-formyl-Trp-Trp-Thr-OBzl, and synthesis and application thereof 首都医科大学 2021-06-08 CN disclosed
EP-3242872-B1 (PIPERIDIN-3-YL)(NAPHTHALEN-2-YL)METHANONE DERIVATIVES AND RELATED COMPOUNDS AS INHIBITORS OF THE HISTONE DEMETHYLASE KDM2B FOR THE TREATMENT OF CANCER GENENTECH INC (US) 2019-07-03 EP disclosed
US-10280149-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2019-05-07 US disclosed
CN-1017708-B METHOD FOR PREPARATION OF PYRAZOLOTRIAZINE COMPOUNDS OTSUKA CHEMICAL CO LTD (JP) 1992-08-05 CN disclosed
US-4824834-A TREATING GOUT OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1989-04-25 US disclosed
EP-0269859-A2 Pyrazolotriazine compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1988-06-08 EP disclosed
CN-87107217-A Method for preparation of pyrazolotriazine compounds 1988-05-11 CN disclosed
EP-0006735-A1 Secondary amines, their preparation, pharmaceutical compositions containing them and their use BEECHAM GROUP PLC (GB) 1980-01-09 EP disclosed
US-3993852-A DIALKYL PHENYLALKANEPHOSPHONATES CIBA-GEIGY AG (CH) 1976-11-23 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 (3 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-10280149-B2 Therapeutic compounds and uses thereof KDM1B, KDM6B, KDM2B LMNA 1915/4885TSHR 4578/4885CA1 2958/4885
US-20180022727-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF KDM1B, KDM6B, KDM2B LMNA 1915/4885TSHR 4578/4885CA1 2958/4885
US-20060183918-A1 Beta 2-adrenergic receptor agonists ADRB2, ADRB1, ADRA2B LMNA 638/4885TSHR 623/4885CA1 4707/4885

“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.