SCHEMBL4943352

SCHEMBL4943352

CC(C)c1ccc2c(c1)CCC1C(C)(CN)CCCC21C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 4/20 1.00
▸ MEN1 O00255 3/20 1.00
▸ KMT2A Q03164 3/20 1.00
▸ TSHR P16473 2/20 1.00
▸ CYP2D6 P10635 2/20 1.00
▸ CYP2C19 P33261 2/20 1.00
▸ PDK1 Q15118 1/20 1.00
▸ PDK2 Q15119 1/20 1.00
▸ PDK3 Q15120 1/20 1.00
▸ PDK4 Q16654 1/20 1.00
▸ CYP2C9 P11712 1/20 1.00
▸ MAPK1 P28482 2/20 0.98
▸ TP53 P04637 1/20 0.98
▸ MAPT P10636 1/20 0.98
▸ ALOX15 P16050 1/20 0.98
▸ NPSR1 Q6W5P4 1/20 0.79
▸ KARS1 Q15046 3/20 0.79
▸ TDP1 Q9NUW8 5/20 0.66
▸ LMNA P02545 1/20 0.65
▸ RXRA P19793 1/20 0.64

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
SCHEMBL17158674 1.00 CYP3A4 (1.00) CYP3A4MEN1KMT2ATSHRCYP2D6
SCHEMBL9108470 1.00 CYP3A4 (1.00) CYP3A4MEN1KMT2ATSHRCYP2D6
SCHEMBL14029315 1.00 CYP3A4 (1.00) CYP3A4MEN1KMT2ATSHRCYP2D6
SCHEMBL31682257 1.00 CYP3A4 (1.00) CYP3A4MEN1KMT2ATSHRCYP2D6
SCHEMBL29380336 1.00 CYP3A4 (1.00) CYP3A4MEN1KMT2ATSHRCYP2D6
SCHEMBL27864 1.00 CYP3A4 (1.00) CYP3A4MEN1KMT2ATSHRCYP2D6
SCHEMBL27863 1.00 CYP3A4 (1.00) CYP3A4MEN1KMT2ATSHRCYP2D6
Hydrochloric Acid SCHEMBL29409504 0.99 CYP3A4 (1.00) CYP3A4MEN1KMT2ATSHRCYP2D6
SCHEMBL5933820 0.99 CYP3A4 (0.98) CYP3A4MEN1KMT2ATSHRCYP2D6
SCHEMBL17453400 0.99 CYP3A4 (0.98) CYP3A4MEN1KMT2ATSHRCYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9410074-B2 Compositions and methods for inhibiting naphthenate solids formation from liquid hydrocarbons M-I L.L.C. (US) 2016-08-09 — — US claimed
EP-2504407-B1 COMPOSITIONS AND METHODS FOR INHIBITING NAPHTHENATE SOLIDS FORMATION FROM LIQUID HYDROCARBONS M I AUSTRALIA PTY LTD (AU) 2015-03-25 — — EP claimed
US-20120310022-A1 Compositions And Methods For Inhibiting Naphthenate Solids Formation From Liquid Hydrocarbons M-I L. L. C. 2012-12-06 — — US claimed
WO-2024043223-A1 FLUX AND METHOD FOR PRODUCING BONDED OBJECT 千住金属工業株式会社 2024-02-29 — — WO disclosed
WO-2024043231-A1 FLUX AND METHOD FOR PRODUCING ELECTRONIC COMPONENT 千住金属工業株式会社 2024-02-29 — — WO disclosed
US-20230302586-A1 FLUX AND SOLDER PASTE SENJU METAL INDUSTRY CO., LTD. (JP) 2023-09-28 — — US disclosed
US-20230302586-A1 FLUX AND SOLDER PASTE SENJU METAL INDUSTRY CO., LTD. (JP) 2023-09-28 — — US disclosed
WO-2023171471-A1 FLUX AND SOLDER PASTE 千住金属工業株式会社 2023-09-14 — — WO disclosed
WO-2023106188-A1 FLUX AND METHOD FOR PRODUCING ASSEMBLY 千住金属工業株式会社 2023-06-15 — — WO disclosed
WO-2023080150-A1 FLUX AND PRODUCTION METHOD FOR JOINED BODY 千住金属工業株式会社 2023-05-11 — — WO disclosed
US-20230067289-A1 ELASTOMERIC COMPOSITION REINFORCED WITH GROUND-BIOCHAR COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2023-03-02 — — US disclosed
US-20070130703-A1 Bringing fiber material into contact with at least one reactive dye containing at least one anionic group, at least one compound which reduces the ionic character of the anionic group, and at least one nucleophilic compound; yields dyeings or prints having deep hues and very good fastness CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2007-06-14 — — US disclosed
US-20040102488-A1 Butenolide and pentenolide derivatives as kinase inhibitors MORPHOCHEM AG (DE) 2004-05-27 — — US disclosed
US-6545040-B1 Method of lowering the blood pressure JANSSEN PHARMACEUTICA N.V. (BE) 2003-04-08 — — US disclosed
EP-0334429-B1 AGENTS FOR LOWERING THE BLOOD PRESSURE JANSSEN PHARMACEUTICA N.V. (BE) 1992-11-19 — — EP disclosed
US-5153069-A For pigments Canestri, Giuseppe (IT) 1992-10-06 — — US disclosed
EP-0189385-B1 POLYESTERAMIDE DISPERSING AGENT Canestri, Giuseppe, Dr. (IT) 1991-05-02 — — EP disclosed
US-4999132-A For organic pigments, inks, paints BERGVIK KEMI AB (SE) 1991-03-12 — — US disclosed
EP-0334429-A1 Agents for lowering the blood pressure JANSSEN PHARMACEUTICA N.V. (BE) 1989-09-27 — — EP disclosed
EP-0189385-A2 Polyesteramide dispersing agent Canestri, Giuseppe, Dr. (IT) 1986-07-30 — — EP 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-20120310022-A1 Compositions And Methods For Inhibiting Naphthenate Solids Formation From Liquid Hydrocarbons NR4A1, NR4A2, NR0B1 CYP3A4 54/4885MEN1 1819/4885KMT2A 2258/4885
US-20040102488-A1 Butenolide and pentenolide derivatives as kinase inhibitors MAP3K20, MAP3K21, MAP3K1 CYP3A4 1647/4885MEN1 2347/4885KMT2A 3752/4885

“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.

Send feedback