SCHEMBL29603907

SCHEMBL29603907

CC1(Cc2cncnc2)C(=O)N(c2ncn[nH]2)c2ccc(-c3ccc(F)c(Cl)c3)cc21

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CACNA1B Q00975 1/20 0.39
▸ PGR P06401 11/20 0.39
▸ NR3C1 P04150 1/20 0.38
▸ NR3C2 P08235 1/20 0.38
▸ AR P10275 1/20 0.38
▸ ITGB2 P05107 1/20 0.36
▸ ICAM1 P05362 1/20 0.36
▸ ITGAL P20701 1/20 0.36
▸ PIK3CD O00329 1/20 0.36
▸ GRIN1 Q05586 4/20 0.35
▸ GRIN2B Q13224 4/20 0.35
▸ GRM2 Q14416 1/20 0.33

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
SCHEMBL3036262 0.85 GRIN1 (0.40) CACNA1BPGRNR3C1NR3C2AR
SCHEMBL3028107 0.84 ITGB2 (0.42) CACNA1BPGRNR3C1NR3C2AR
SCHEMBL2786954 0.83 PGR (0.38) CACNA1BPGRNR3C1NR3C2AR
SCHEMBL2804798 0.83 CACNA1B (0.37) CACNA1BPGRNR3C1NR3C2AR
SCHEMBL3042679 0.82 PIK3CA (0.36) CACNA1BPGRNR3C1NR3C2AR
SCHEMBL3033572 0.81 GRIN1 (0.43) CACNA1BPGRNR3C1NR3C2AR
SCHEMBL3043842 0.80 CACNA1B (0.37) CACNA1BPGRNR3C1NR3C2AR
SCHEMBL2806300 0.77 ITGB2 (0.37) CACNA1BPGRNR3C1NR3C2AR
SCHEMBL8052840 0.76 PGR (0.55) CACNA1BPGRNR3C1NR3C2AR
SCHEMBL3019210 0.76 PGR (0.55) CACNA1BPGRNR3C1NR3C2AR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250152568-A1 METHODS OF TREATING COMPLEX REGIONAL PAIN SYNDROME AISA PHARMA, INC. 2025-05-15 — — US claimed
EP-4475887-A1 METHODS OF TREATING COMPLEX REGIONAL PAIN SYNDROME Aisa Pharma, Inc. (US) 2024-12-18 — — EP claimed
WO-2024211216-A1 CILNIDIPINE AND A P-GLYCOPROTEIN INHIBITOR FOR TREATING PAIN AISA PHARMA, INC. (US) 2024-10-10 — — WO claimed
WO-2023150336-A1 METHODS OF TREATING COMPLEX REGIONAL PAIN SYNDROME AISA PHARMA, INC. (US) 2023-08-10 — — WO claimed
EP-4683634-A1 TREATMENT OF SCLERODERMA Aisa Pharma, Inc. (US) 2026-01-28 — — EP disclosed
EP-4646205-A2 COMBINATION THERAPIES FOR TREATMENT OF HEARING DISORDERS Gateway Biotechnology, Inc. (US) 2025-11-12 — — EP disclosed
US-20250152568-A1 METHODS OF TREATING COMPLEX REGIONAL PAIN SYNDROME AISA PHARMA, INC. 2025-05-15 — — US disclosed
EP-4523748-A2 TREATMENT OF PAIN AND VASOCONSTRICTION Aisa Pharma, Inc. (US) 2025-03-19 — — EP disclosed
US-20250017940-A1 SELECTIVE PEPTIDOMIMETIC MODULATORS OF CAV2.2 (N-TYPE) VOLTAGE-GATED CALCIUM CHANNELS AND USES THEREOF NEW YORK UNIVERSITY (US) 2025-01-16 — — US disclosed
EP-4475887-A1 METHODS OF TREATING COMPLEX REGIONAL PAIN SYNDROME Aisa Pharma, Inc. (US) 2024-12-18 — — EP disclosed
US-20240398771-A1 TREATMENT OF SCLERODERMA AND RAYNAUD'S SYNDROME AISA PHARMA, INC. 2024-12-05 — — US disclosed
EP-4114466-B1 TREATMENT OF PAIN AND VASOCONSTRICTION AISA PHARMA INC (US) 2024-12-04 — — EP disclosed
EP-4251164-A2 TREATMENT OF RAYNAUD'S DISEASE Aisa Pharma, Inc. (US) 2023-10-04 — — EP disclosed
WO-2023150336-A1 METHODS OF TREATING COMPLEX REGIONAL PAIN SYNDROME AISA PHARMA, INC. (US) 2023-08-10 — — WO disclosed
US-20230115611-A1 TREATMENT OF PAIN AND VASOCONSTRICTION AISA PHARMA, INC. 2023-04-13 — — US disclosed
US-20230073534-A1 MODULATING TLR/NF-KB AND P53 SIGNALING PATHWAYS TO ENHANCE INTERSPECIES CHIMERISM BETWEEN EVOLUTIONARYILY DISTANT SPECIES THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2023-03-09 — — US disclosed
EP-4114466-A1 TREATMENT OF PAIN AND VASOCONSTRICTION Aisa Pharma, Inc. (US) 2023-01-11 — — EP disclosed
WO-2022115576-A9 TREATMENT OF RAYNAUD'S DISEASE AISA PHARMA, INC. (US) 2022-08-18 — — WO disclosed
WO-2022115576-A2 TREATMENT OF RAYNAUD'S DISEASE AISA PHARMA, INC. (US) 2022-06-02 — — WO disclosed
US-20220168286-A1 TREATMENT OF RAYNAUD'S DISEASE AISA PHARMA, INC. 2022-06-02 — — 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-20250017940-A1 SELECTIVE PEPTIDOMIMETIC MODULATORS OF CAV2.2 (N-TYPE) VOLTAGE-GATED CALCIUM CHANNELS AND USES THEREOF CACNA1B, CACNA1E, CACNA1D CACNA1B 1/4885PGR 4085/4885NR3C1 3010/4885

“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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