SCHEMBL14112950

SCHEMBL14112950

Fc1ccccc1-c1nnc(S)o1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 6/20 0.51
▸ RAB9A P51151 6/20 0.51
▸ HPGD P15428 3/20 0.51
▸ PKM P14618 2/20 0.51
▸ HTT P42858 1/20 0.51
▸ RXFP1 Q9HBX9 1/20 0.51
▸ NOTUM Q6P988 2/20 0.50
▸ EGFR P00533 1/20 0.50
▸ KDM4E B2RXH2 4/20 0.48
▸ ALDH1A1 P00352 3/20 0.48
▸ LMNA P02545 1/20 0.48
▸ GUSB P08236 2/20 0.43
▸ CPB1 P15086 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ C1R P00736 1/20 0.42
▸ SMN1; SMN2 Q16637 3/20 0.42
▸ TP53 P04637 1/20 0.42
▸ CASP3 P42574 1/20 0.42
▸ SENP8 Q96LD8 1/20 0.42
▸ SENP7 Q9BQF6 1/20 0.42

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
SCHEMBL29811008 1.00 NPC1 (0.51) NPC1RAB9AHPGDPKMHTT
SCHEMBL6451424 0.86 NPC1 (0.64) NPC1RAB9AHPGDPKMHTT
SCHEMBL29006460 0.78 ACHE (0.45) NPC1RAB9AHPGDKDM4EALDH1A1
SCHEMBL28632605 0.77 NPC1 (0.59) NPC1RAB9AHPGDPKMHTT
SCHEMBL7729357 0.77 NPC1 (0.59) NPC1RAB9AHPGDEGFRKDM4E
SCHEMBL29810999 0.77 RAB9A (0.74) NPC1RAB9AHPGDRXFP1NOTUM
SCHEMBL2800972 0.77 ALDH1A1 (0.51) NPC1RAB9AHPGDPKMHTT
SCHEMBL9059010 0.77 NPC1 (0.74) NPC1RAB9AHPGDNOTUMEGFR
SCHEMBL14112946 0.77 RAB9A (0.74) NPC1RAB9AHPGDRXFP1NOTUM
SCHEMBL29529901 0.77 NPC1 (0.74) NPC1RAB9AHPGDNOTUMEGFR

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113461630-B Nootkatone thioether derivative containing 1,3, 4-oxadiazole ring, and preparation method and application thereof 郑州大学 2022-09-02 — — CN claimed
CN-113461630-A Nootkatone thioether derivative containing 1,3, 4-oxadiazole ring, and preparation method and application thereof 郑州大学 2021-10-01 — — CN claimed
CN-113461630-B Nootkatone thioether derivative containing 1,3, 4-oxadiazole ring, and preparation method and application thereof 郑州大学 2022-09-02 — — CN disclosed
CN-113461630-A Nootkatone thioether derivative containing 1,3, 4-oxadiazole ring, and preparation method and application thereof 郑州大学 2021-10-01 — — CN disclosed
US-10851072-B2 Inhibitors of Rho/MRTF/SRF-mediated gene transcription and methods for use of the same THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2020-12-01 — — US disclosed
US-10851072-B2 Inhibitors of Rho/MRTF/SRF-mediated gene transcription and methods for use of the same THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2020-12-01 — — US disclosed
US-20190308947-A1 INHIBITORS OF RHO/MRTF/SRF-MEDIATED GENE TRANSCRIPTION AND METHODS FOR USE OF THE SAME THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2019-10-10 — — US disclosed
US-20190308947-A1 INHIBITORS OF RHO/MRTF/SRF-MEDIATED GENE TRANSCRIPTION AND METHODS FOR USE OF THE SAME THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2019-10-10 — — US disclosed
WO-2019195641-A2 INHIBITORS OF RHO/MRTF/SRF-MEDIATED GENE TRANSCRIPTION AND METHODS FOR USE OF THE SAME THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2019-10-10 — — WO disclosed
WO-2019195641-A2 INHIBITORS OF RHO/MRTF/SRF-MEDIATED GENE TRANSCRIPTION AND METHODS FOR USE OF THE SAME THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2019-10-10 — — WO disclosed
CN-105330651-B 1 containing (miscellaneous) aryl and piperazine, 2,4- triazolinthione derivatives and preparation method and application 南开大学 2018-05-01 — — CN disclosed
CN-105541748-B 1,3,4 oxadiazole Mannich base class compounds and preparation and application containing piperazine 南开大学 2017-09-12 — — CN disclosed
CN-105541748-A Piperazine-contained 1,3,4-oxadiazole Mannich base compound, and preparation and application thereof UNIV NANKAI 2016-05-04 — — CN disclosed
CN-105330651-A 1,2,4-Triazolethione derivative containing (hetero)aryl group and piperazine, and preparation method and application thereof UNIV NANKAI 2016-02-17 — — CN disclosed
US-20080160452-A1 Developer for light sensitive planographic printing plate material and manufacturing process of planographic printing plate employing the same KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2008-07-03 — — US disclosed
US-20080160452-A1 Developer for light sensitive planographic printing plate material and manufacturing process of planographic printing plate employing the same KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2008-07-03 — — 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-20190308947-A1 INHIBITORS OF RHO/MRTF/SRF-MEDIATED GENE TRANSCRIPTION AND METHODS FOR USE OF THE SAME RHOXF2, BPTF, SREBF1 NPC1 480/4885RAB9A 418/4885HPGD 1333/4885
US-10851072-B2 Inhibitors of Rho/MRTF/SRF-mediated gene transcription and methods for use of the same RHOXF2, BPTF, SREBF1 NPC1 480/4885RAB9A 418/4885HPGD 1333/4885

“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.

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