SCHEMBL110676

SCHEMBL110676

COc1cc(N)ccc1F

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.55
GAA P10253 2/20 0.55
MAPK1 P28482 2/20 0.55
TSHR P16473 1/20 0.55
HTT P42858 1/20 0.55
ALDH1A1 P00352 4/20 0.50
KDM4E B2RXH2 3/20 0.50
NR4A1 P22736 1/20 0.48
USP2 O75604 1/20 0.47
LMNA P02545 2/20 0.46
KIT P10721 1/20 0.43
IMPDH2 P12268 1/20 0.42
IMPDH1 P20839 1/20 0.42
CYP19A1 P11511 3/20 0.41
KDM1A O60341 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
BACE1 P56817 1/20 0.41
AMY1A P0DUB6 1/20 0.40
CYP3A4 P08684 1/20 0.40

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
Hydrochloric Acid SCHEMBL5745582 0.98 MAPT (0.53) MAPTGAAMAPK1TSHRHTT
Nitric Acid SCHEMBL27764480 0.86 ALDH1A1 (0.47) MAPTGAAMAPK1TSHRHTT
SCHEMBL11695156 0.84 ALDH1A1 (0.53) TSHRALDH1A1CYP19A1KDM1ATDP1
SCHEMBL76201 0.82 ALDH1A1 (0.52) MAPTGAAMAPK1TSHRHTT
SCHEMBL16659206 0.81 SMN1; SMN2 (0.56) MAPTGAAMAPK1TSHRALDH1A1
Hydrochloric Acid SCHEMBL27868120 0.80 MAPT (0.53) MAPTGAAMAPK1TSHRHTT
SCHEMBL29287691 0.79 KIT (0.52) MAPTGAAMAPK1TSHRHTT
SCHEMBL30898567 0.79 ALDH1A1 (0.58) MAPTGAAMAPK1TSHRHTT
SCHEMBL77823 0.78 KDM4E (0.67) MAPTGAAMAPK1TSHRHTT
SCHEMBL2438047 0.78 KDM4E (0.67) MAPTGAAMAPK1TSHRHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4584261-A1 MODULATORS OF ALPHA-1 ANTITRYPSIN Vertex Pharmaceuticals Incorporated (US) 2025-07-16 EP claimed
CN-120166990-A Alpha-1 antitrypsin modulators 弗特克斯药品有限公司 2025-06-17 CN claimed
US-20240158404-A1 MODULATORS OF ALPHA-1 ANTITRYPSIN VERTEX PHARMACEUTICALS INCORPORATED 2024-05-16 US claimed
WO-2024054624-A1 MODULATORS OF ALPHA-1 ANTITRYPSIN VERTEX PHARMACEUTICALS INCORPORATED (US) 2024-03-14 WO claimed
US-10696611-B2 Adamantane derivative compound AMOREPACIFIC CORPORATION (KR) 2020-06-30 US claimed
EP-1773768-B1 PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS EXELIXIS INC (US) 2018-08-22 EP claimed
US-20170283347-A1 NOVEL ADAMANTANE DERIVATIVE COMPOUND AMOREPACIFIC CORPORATION (KR) 2017-10-05 US claimed
EP-3187486-A1 NOVEL ADAMANTANE DERIVATIVE COMPOUND Amorepacific Corporation (KR) 2017-07-05 EP claimed
US-8288552-B2 Dihydropyridone amidesas P2X7 modulators ROCHE PALO ALTO LLC (US) 2012-10-16 US claimed
CN-101450906-A Method for preparing 3-amino-4-fluorophenol TAIXING KANGPENG CHEMICALS CO (CN) 2009-06-10 CN claimed
EP-1773768-A4 PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS EXELIXIS INC (US) 2008-08-06 EP claimed
EP-1773768-A2 PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS Exelixis, Inc. (US) 2007-04-18 EP claimed
WO-2006012642-A2 PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS EXELIXIS, INC. (US) 2006-02-02 WO claimed
EP-4747241-A1 BENZIMIDAZOLE DERIVATIVES Syngenta Crop Protection AG (CH) 2026-05-27 EP disclosed
CN-122036709-A Halogenated anisole-containing side chain dithienyl pyrrole monomer, conjugated polymer, preparation method and application 南阳师范学院 2026-05-15 CN disclosed
EP-4695248-A1 PYRAZOLO[1,5-A]PYRIDINE DERIVATIVES Syngenta Crop Protection AG (CH) 2026-02-18 EP disclosed
US-4593037-A Compound substituted with phenyl rings PFIZER INC. (US) 1986-06-03 US disclosed
EP-0175452-A1 1,3-Disubstituted piperidine compounds as neuroleptic agents PFIZER INC. (US) 1986-03-26 EP disclosed
US-4145364-A PREPARATION OF FLUORINATED ANILINES MERCK & CO., INC. (US) 1979-03-20 US disclosed
US-4044049-A Phenyl benzoic acid compounds MERCK & CO., INC. (US) 1977-08-23 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 (3 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-10696611-B2 Adamantane derivative compound ADAM8, BACE1, CYP17A1 MAPT 1527/4885GAA 743/4885MAPK1 2937/4885
US-20170283347-A1 NOVEL ADAMANTANE DERIVATIVE COMPOUND ADAM8, CYP17A1, ADAM10 MAPT 1766/4885GAA 1163/4885MAPK1 2795/4885
US-20240158404-A1 MODULATORS OF ALPHA-1 ANTITRYPSIN SERPINA2, SERPINA3, SERPINB1 MAPT 1912/4885GAA 142/4885MAPK1 2125/4885

“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.