SCHEMBL4537744

SCHEMBL4537744

c1ccc(Cc2cc[nH]c2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CALM1 P0DP23 1/20 0.57
TAAR1 Q96RJ0 3/20 0.41
LTA4H P09960 2/20 0.40
CAPN1 P07384 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
IDH1 O75874 1/20 0.39
DAO P14920 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
LMNA P02545 2/20 0.38
PLA2G10 O15496 1/20 0.38
PLA2G2A P14555 1/20 0.38
BCL2 P10415 1/20 0.37
BCL2L1 Q07817 1/20 0.37
SLC22A2 O15244 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36
CYP1A2 P05177 1/20 0.35
ADRA2A P08913 1/20 0.35
CYP2D6 P10635 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
Hydrochloric Acid SCHEMBL27693313 0.98 CALM1 (0.55) CALM1TAAR1LTA4HCAPN1MEN1
SCHEMBL27596816 0.81 CAPN1 (0.48) TAAR1CAPN1DAOALDH1A1HPGD
SCHEMBL29691485 0.77 DAO (0.42) TAAR1CAPN1DAOALDH1A1HPGD
SCHEMBL28597419 0.77 HRH3 (0.40) TAAR1CAPN1ALDH1A1HRH3CYP1A2
SCHEMBL28600438 0.77 DAO (0.42) TAAR1LTA4HCAPN1MEN1KMT2A
SCHEMBL28201452 0.77 SMN1; SMN2 (0.38) TAAR1CAPN1ALDH1A1LMNATSHR
SCHEMBL7957706 0.76 TSHR (0.62) LTA4HCAPN1ALDH1A1TSHR
Diphenylmethane SCHEMBL14763944 0.76 CALM1 (1.00) CALM1LTA4HIDH1ALDH1A1HPGD
Diphenylmethane SCHEMBL4361124 0.76 CALM1 (1.00) CALM1LTA4HIDH1ALDH1A1HPGD
Diphenylmethane SCHEMBL1303 0.76 CALM1 (1.00) CALM1LTA4HIDH1ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109715631-A 6 inhibitor of TRAF 德国亥姆霍兹慕尼黑中心健康与环境研究中心(有限公司) 2019-05-03 CN claimed
CN-106032355-B A kind of method that pyridine side chain c h bond is direct oxidation into ketone 中国科学院大连化学物理研究所 2019-01-04 CN claimed
CN-101818100-B Preparation method of polybutylcyanoacrylate-encapsulated jasminum grandiflorum essence capsule SHANGHAI INST TECHNOLOGY 2012-06-06 CN claimed
CN-101811015-B Preparation method of jasmine sambac essence capsule SHANGHAI INST TECHNOLOGY 2011-11-09 CN claimed
CN-101818100-A Preparation method of polybutylcyanoacrylate-encapsulated jasminum grandiflorum essence capsule SHANGHAI INST TECHNOLOGY 2010-09-01 CN claimed
CN-101811015-A Preparation method of jasmine sambac essence capsule SHANGHAI INST TECHNOLOGY 2010-08-25 CN claimed
CN-101378879-A Dry ice blasting with chemical additives AIR LIQUIDE (FR) 2009-03-04 CN claimed
WO-1998003608-A1 CORROSION INHIBITING PROCESSES FOR REFRIGERATION SYSTEMS MEKHJIAN MANUEL S (US) 1998-01-29 WO claimed
US-5066748-A Silicon containing polypyrrole THE UNITED STATES OF AMERICA AS REPRESENTED BY THE ADMINISTRATOR OF THE NATIONAL AERONAUTICS AND SPACE ADMINISTRATION (US) 1991-11-19 US claimed
US-4818646-A DOPING WITH TRANSITION METAL COMPLEX RICOH COMPANY, LTD. (JP) 1989-04-04 US claimed
CN-120209934-A Narcissus essence and preparation method thereof 厦门馨米兰香精香料有限公司 2025-06-27 CN disclosed
US-20250090498-A1 TREATMENT OF PRIMARY CTLA-4 CHECKPOINT RELATED IMMUNODEFICIENCIES ADIENNE PHARMA & BIOTECH SA (CH) 2025-03-20 US disclosed
CN-118234470-B Perfuming complex of natural origin, perfuming composition and aqueous fragrance composition 伊碧申香料有限公司 2025-03-07 CN disclosed
CN-118697732-B Composite preparation containing indole and 3-substituted indole derivative and application thereof 自然资源部第一海洋研究所 2025-02-25 CN disclosed
CN-118697732-A Composite preparation containing indole and 3-substituted indole derivative and application thereof 自然资源部第一海洋研究所 2024-09-27 CN disclosed
EP-0140322-B1 POLYMER CATALYST TRANSDUCERS AND USE THEREOF IN TEST KITS FOR ANALYTICAL METHODS MILES INC. (US) 1989-01-25 EP disclosed
US-4560534-A Polymer catalyst transducers MILES LABORATORIES, INC. (US) 1985-12-24 US disclosed
EP-0140322-A2 Polymer catalyst transducers and use thereof in test kits for analytical methods MILES INC. (US) 1985-05-08 EP disclosed
US-4336194-A Benzyl pyrrolyl methyl carboxylate insecticides and acaricides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1982-06-22 US disclosed
US-4212879-A Benzyl pyrrolyl methyl carboxylate insecticides and acaricides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1980-07-15 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-20250090498-A1 TREATMENT OF PRIMARY CTLA-4 CHECKPOINT RELATED IMMUNODEFICIENCIES CD274, PDCD1, ICOS CALM1 3727/4885TAAR1 1754/4885LTA4H 716/4885

“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.