SCHEMBL29638845

SCHEMBL29638845

C[C@H](OCC(=O)O)[C@@H](C)Sc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ VCAM1 P19320 13/20 0.48
▸ GPR55 Q9Y2T6 1/20 0.45
▸ HPN P05981 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ ALOX15 P16050 1/20 0.41
▸ SIRT5 Q9NXA8 1/20 0.41
▸ GLRA3 O75311 1/20 0.37
▸ GLRB P48167 1/20 0.37
▸ HMGCR P04035 1/20 0.36
▸ LMNA P02545 1/20 0.35
▸ RECQL P46063 1/20 0.35
▸ PTGDR2 Q9Y5Y4 1/20 0.35

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
SCHEMBL6438215 1.00 VCAM1 (0.48) VCAM1GPR55HPNMAPTALOX15
SCHEMBL9158690 0.78 HPN (0.44) VCAM1GPR55HPNMAPTALOX15
SCHEMBL9680927 0.77 HPN (0.41) VCAM1HPNMAPTALOX15SIRT5
SCHEMBL9158352 0.76 VCAM1 (0.46) VCAM1GPR55HPNMAPTALOX15
SCHEMBL9314272 0.76 MAOB (0.47) LMNA
SCHEMBL9330356 0.76 HPN (0.47) VCAM1GPR55HPNMAPTALOX15
SCHEMBL9847649 0.74 VCAM1 (0.46) VCAM1GPR55HPNMAPTALOX15
SCHEMBL9163349 0.73 HPN (0.45) VCAM1HPNMAPTALOX15SIRT5
SCHEMBL9328104 0.73 HPN (0.52) VCAM1HPNMAPTALOX15SIRT5
SCHEMBL8823307 0.73 HPN (0.52) VCAM1HPNMAPTALOX15SIRT5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4658247-A1 COMPOSITIONS AND METHODS FOR TREATING HYPERPROCALCITONEMIA Vivacelle Bio, Inc. (US) 2025-12-10 — — EP disclosed
US-20250195630-A1 COMPOSITIONS, METHODS AND USES OF ALPHA 1-ANTITRYPSIN FOR TREATMENT OF GRAFT VERSUS HOST DISEASE THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE 2025-06-19 — — US disclosed
US-20250101131-A1 COMPOSITIONS AND METHODS OF USE FOR ALPHA-1 ANTITRYPSIN FUSION POLYPEPTIDES KONKUK UNIVERSITY (KR) 2025-03-27 — — US disclosed
US-20240315969-A1 COMPOSITIONS AND METHODS FOR TREATING OR PREVENTING MULTIPLE ORGAN DYSFUNCTION SYNDROME VIVACELLE BIO INC. 2024-09-26 — — US disclosed
WO-2024163181-A1 COMPOSITIONS AND METHODS FOR TREATING HYPERPROCALCITONEMIA VIVACELLE BIO, INC. (US) 2024-08-08 — — WO disclosed
US-12036321-B2 Compositions and methods for treating or preventing multiple organ dysfunction syndrome VIVACELLE BIO, INC. (US) 2024-07-16 — — US disclosed
US-12030958-B2 Compositions and methods of use of alpha-1 antitrypsin fusion polypeptides THE REGENTS OF THE UNIVERSITY OF COLORADO (US) 2024-07-09 — — US disclosed
US-20240009126-A1 COMPOSITIONS AND METHODS FOR TREATING OR PREVENTING MULTIPLE ORGAN DYSFUNCTION SYNDROME VIVACELLE BIO INC. 2024-01-11 — — US disclosed
CN-115715221-A Compositions and methods for treating or preventing multiple organ dysfunction syndrome 维生宝生物股份有限公司 2023-02-24 — — CN disclosed
EP-4126250-A1 COMPOSITIONS AND METHODS FOR TREATING OR PREVENTING MULTIPLE ORGAN DYSFUNCTION SYNDROME Vivacelle Bio, Inc. (US) 2023-02-08 — — EP disclosed
US-20220204646-A1 Compositions and Methods of Use of Alpha-1 Antitrypsin Fusion Polypeptides KONKUK UNIVERSITY (KR) 2022-06-30 — — US disclosed
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