SCHEMBL14865782

SCHEMBL14865782

O=C(NC(=S)NC1CCCCC1)c1ccc(Cl)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.76
NPC1 O15118 9/20 0.74
RAB9A P51151 7/20 0.74
NPSR1 Q6W5P4 1/20 0.61
ALDH1A1 P00352 5/20 0.59
MEN1 O00255 3/20 0.59
KMT2A Q03164 3/20 0.59
POLB P06746 2/20 0.59
GAA P10253 1/20 0.58
SMN1; SMN2 Q16637 4/20 0.57
ALOX12 P18054 3/20 0.57
LMNA P02545 2/20 0.57
CYP2C9 P11712 1/20 0.54
CYP2C19 P33261 1/20 0.54

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
SCHEMBL12196200 0.86 EPHX1 (1.00) EPHX1NPC1RAB9AALDH1A1MEN1
SCHEMBL8303337 0.85 EPHX1 (0.77) EPHX1NPC1RAB9AALDH1A1MEN1
SCHEMBL14860025 0.85 NPC1 (0.74) EPHX1NPC1RAB9AALDH1A1MEN1
SCHEMBL1604644 0.84 RAB9A (1.00) NPC1RAB9AALDH1A1KMT2AGAA
SCHEMBL16108484 0.84 RAB9A (1.00) NPC1RAB9AALDH1A1KMT2AGAA
SCHEMBL2351318 0.82 RAB9A (0.70) EPHX1NPC1RAB9AALDH1A1MEN1
SCHEMBL16587394 0.81 RAB9A (1.00) NPC1RAB9AALDH1A1MEN1KMT2A
SCHEMBL21741924 0.81 NPC1 (0.68) EPHX1NPC1RAB9AALDH1A1MEN1
SCHEMBL8750215 0.81 NPC1 (0.76) EPHX1NPC1RAB9AALDH1A1MEN1
SCHEMBL21023740 0.80 EPHX1 (0.54) EPHX1NPC1RAB9ANPSR1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210171810-A1 Two Step Adhesive System HENKEL AG & CO. KGAA (DE) 2021-06-10 US disclosed
US-20210163799-A1 Two-Part, Cyanoacrylate/Free Radically Curable Adhesive Systems HENKEL AG & CO. KGAA (DE) 2021-06-03 US disclosed
US-10590311-B2 Accelerators for two part curable compositions Henkel IP & Holding GmbH (DE) 2020-03-17 US disclosed
WO-2020035580-A1 TWO STEP ADHESIVE SYSTEMS Henkel IP & Holding GmbH (DE) 2020-02-20 WO disclosed
US-9371473-B2 Accelerators for two step adhesive systems Henkel IP & Holding GmbH (DE) 2016-06-21 US disclosed
US-9371473-B2 Accelerators for two step adhesive systems Henkel IP & Holding GmbH (DE) 2016-06-21 US disclosed
US-9365750-B2 Accelerators for curable compositions Henkel IP & Holding GmbH (DE) 2016-06-14 US disclosed
US-9365750-B2 Accelerators for curable compositions Henkel IP & Holding GmbH (DE) 2016-06-14 US disclosed
US-8986847-B2 Accelerator/oxidant/proton source combinations for two part curable compositions Henkel IP & Holding GmbH (DE) 2015-03-24 US disclosed
US-8986847-B2 Accelerator/oxidant/proton source combinations for two part curable compositions Henkel IP & Holding GmbH (DE) 2015-03-24 US disclosed
US-20130096138-A1 NOVEL THIOUREA OR UREA DERIVATIVE, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING AIDS, CONTAINING SAME AS ACTIVE INGREDIENT AVIXGEN INC. (KR) 2013-04-18 US disclosed
US-20130096138-A1 NOVEL THIOUREA OR UREA DERIVATIVE, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING AIDS, CONTAINING SAME AS ACTIVE INGREDIENT AVIXGEN INC. (KR) 2013-04-18 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-20130096138-A1 NOVEL THIOUREA OR UREA DERIVATIVE, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING AIDS, CONTAINING SAME AS ACTIVE INGREDIENT UGP2, TPMT, UPP1 EPHX1 2152/4885NPC1 1260/4885RAB9A 2456/4885

“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.