SCHEMBL13646232

SCHEMBL13646232

OC1(c2ccc(C(F)(F)F)nc2)CCNCC1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.47
TRPV4 Q9HBA0 1/20 0.41
P2RX7 Q99572 14/20 0.37
KCNH2 Q12809 1/20 0.36
CNR2 P34972 1/20 0.34

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
SCHEMBL31383720 0.83 TRPV4 (0.42) TRPV4P2RX7KCNH2
SCHEMBL27196766 0.83 TRPV4 (0.42) TRPV4P2RX7KCNH2
SCHEMBL31698330 0.80 P2RX7 (0.35) TRPV4P2RX7CNR2
SCHEMBL13646216 0.79 DRD2 (0.51) DRD2P2RX7KCNH2
SCHEMBL180972 0.78 SYK (0.40) DRD2KCNH2
Hydrochloric Acid SCHEMBL2885444 0.78 DRD2 (0.50) DRD2P2RX7KCNH2
SCHEMBL20753967 0.77 DRD2 (0.42) DRD2
SCHEMBL1750265 0.76 DRD2 (0.61) DRD2
SCHEMBL653874 0.75 DRD2 (0.59) DRD2KCNH2
Hydrochloric Acid SCHEMBL23578391 0.73 DRD2 (0.58) DRD2KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250382282-A1 NITROGEN-CONTAINING SATURATED HETEROCYCLYL DERIVATIVE Sumitomo Pharma Co., Ltd. (JP) 2025-12-18 US disclosed
US-12398125-B2 Nitrogen-containing saturated heterocyclyl derivative Sumitomo Pharma Co., Ltd. (JP) 2025-08-26 US disclosed
EP-4563574-A1 NITROGEN-CONTAINING SATURATED HETEROCYCLIC RING DERIVATIVE Sumitomo Pharma Co., Ltd. (JP) 2025-06-04 EP disclosed
CN-119630649-A Nitrogen-containing saturated heterocyclic derivative 住友制药株式会社 2025-03-14 CN disclosed
US-20250051305-A1 NITROGEN-CONTAINING SATURATED HETEROCYCLYL DERIVATIVE Sumitomo Pharma Co., Ltd. (JP) 2025-02-13 US disclosed
US-12172987-B2 Nitrogen-containing saturated heterocyclyl derivative Sumitomo Pharma Co., Ltd. (JP) 2024-12-24 US disclosed
US-20240124429-A1 NITROGEN-CONTAINING SATURATED HETEROCYCLYL DERIVATIVE Sumitomo Pharma Co., Ltd. (JP) 2024-04-18 US disclosed
WO-2024024962-A1 NITROGEN-CONTAINING SATURATED HETEROCYCLIC RING DERIVATIVE 住友ファーマ株式会社 2024-02-01 WO disclosed
WO-2023102022-A1 4-PHENYL-2-(1H-1,2,3-TRIAZOL-4-YL)PIPERIDIN-4-OL DERIVATIVES AS INHIBITORS OF APOL1 AND METHODS OF USING SAME VERTEX PHARMACEUTICALS INCORPORATED (US) 2023-06-08 WO disclosed
US-7598243-B2 inhibit atherosclerotic lesion formation and pathological progression by impairing monocyte recruitment and differentiation in the arterial wall; antiinflammatory, anticarcinogenic agent; autoimmune diseases MERCK & CO., INC. (US) 2009-10-06 US disclosed
US-7598243-B2 inhibit atherosclerotic lesion formation and pathological progression by impairing monocyte recruitment and differentiation in the arterial wall; antiinflammatory, anticarcinogenic agent; autoimmune diseases MERCK & CO., INC. (US) 2009-10-06 US disclosed
US-20080081803-A1 Heterocyclic cyclopentyl tetrahydroisoquinoline and tetrahydropyridopyridine modulators of chemokine receptor activity MERCK SHARP & DOHME CORP. 2008-04-03 US disclosed
US-20080081803-A1 Heterocyclic cyclopentyl tetrahydroisoquinoline and tetrahydropyridopyridine modulators of chemokine receptor activity MERCK SHARP & DOHME CORP. 2008-04-03 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 (6 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-20250382282-A1 NITROGEN-CONTAINING SATURATED HETEROCYCLYL DERIVATIVE H1-0, HTT, PRNP DRD2 738/4885TRPV4 3938/4885P2RX7 1856/4885
US-20080081803-A1 Heterocyclic cyclopentyl tetrahydroisoquinoline and tetrahydropyridopyridine modulators of chemokine receptor activity CCR1, CCR5, CCR2 DRD2 179/4885TRPV4 560/4885P2RX7 198/4885
US-12172987-B2 Nitrogen-containing saturated heterocyclyl derivative H1-0, HTT, PRNP DRD2 738/4885TRPV4 3938/4885P2RX7 1856/4885
US-12398125-B2 Nitrogen-containing saturated heterocyclyl derivative H1-0, HTT, PRNP DRD2 738/4885TRPV4 3938/4885P2RX7 1856/4885
US-20240124429-A1 NITROGEN-CONTAINING SATURATED HETEROCYCLYL DERIVATIVE H1-0, HTT, PRNP DRD2 738/4885TRPV4 3938/4885P2RX7 1856/4885
US-20250051305-A1 NITROGEN-CONTAINING SATURATED HETEROCYCLYL DERIVATIVE H1-0, HTT, PRNP DRD2 738/4885TRPV4 3938/4885P2RX7 1856/4885

“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.